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Spectra & Spectral Data: By Type of Spectra

How to find spectra and spectral data using free and UB subscription databases
Last Updated: Aug 14, 2019 11:53 AM

Intro

For all listings, an asterisk (*) indicates the resource contains actual spectra. Print sources are located on the Science & Engineering Information Center reference shelves on the 1st floor of the Lockwood Library and are listed with their Library of Congress call numbers.

Spectra Resources by Type

General Sources

* Atlas of spectral data and physical constants for organic compounds
2d ed. Cleveland: CRC Press,
Lockwood Science & Engineering Reference QD257.7 .G7 1975 v.1-v.6
Tabular condensation of spectral data from numerous published collections. Vol. 1 contains name/synonym directory, structures, and spectroscopic aids; Vols. 2-4 contain data tables; vols. 5-6 have indexes of molecular weight, physical constants, WLNs, mass spectra, Raman, etc.

* ChemSpider (Royal Society of Chemistry)

http://www.chemspider.com/
ChemSpider extracts a wide range of information about chemicals and materials by crawling the Internet. The Spectra heading may contain a wide range of spectra: IR, HNMR, C13 NMR, UV-Vis, electron impact, and mass spectra. As an open source database, scientists throughout the world can upload additional spectra. The Data Sources heading provides a rich set of physical, biological, metabolic, toxicology, environmental data in addition to spectral and more safety data. The Properties heading provides basic property and safety information. ChemSpider can be searched by names, substructures and InChI identifiers.

CRC Handbook of Data on Organic Compounds
Lockwood Science & Engineering Reference QD257.7 .C73 1985 v. 1-2
Major data collection of names, synonyms, structures, formulas, physical constants, spectral data references: (IR, Raman, NMR, UV, Mass) CAS Registry Numbers, Beilstein references.

Dictionary of organic compounds
London: Chapman & Hall
Lockwood Science & Engineering Reference QD251.D49 1982
Published in 5 volumes and 10 supplements. Literature references provided.

Encyclopedia of analytical chemistry: applications, theory, and instrumentation / Robert A. Meyers. New York: Wiley, 2000.
Lockwood Science & Engineering Reference QD71.5.E52 2000
Extensive review chapters. Vol. 1-10 has chapters by type of substance (i.e. pesticides). Vol. 11-15 has chapters by analytical technique.

Encyclopedia of spectroscopy / Heinz-Helmut Perkampus
Weinheim; New York: VCH, 1995.
Lockwood Science & Engineering Reference QC450.3 .P47 1995
General illustrated definitions of concepts and techniques

Handbook of spectroscopy
Cleveland: CRC Press, c1974.
Lockwood Book Collection QD95 .H27 v.1-2.
Tables of data and references of available data in various fields of spectroscopy. Each volume is indexed separately.

* KnowItAll Informatics System Academic Edition
Free download at: http://www.knowitall.com/academic. Free software package includes applications for drawing 3D structures, creating reports with imported structures and spectra, processing of NMR, IR, and Raman spectra, predicting and simulating proton NMR spectra, analyzing functional groups, symmetry, point groups, and accessing the Sadtler Handbook of Infrared Spectroscopy .

Molecular spectra and molecular structure / Gerhard Herzberg
Lockwood Book Collection QC451 .H379 v.1-4.
Classic treatise.

* NIST Chemistry Webbook
http://webbook.nist.gov/chemistry/
IR spectra for over 16,000 compounds, Mass spectra for over 33,000 compounds, UV/Vis spectra for over 1,6000 compounds, Gas Chromatography for over 27,000, Electronic and vibrational spectra for over 5000 compounds.

* Sadtler collections
Various Sadtler collections and indexes are available in print and microform located in the Lockwood Library and the off-site Library annex. Check the UB Libraries Catalog by searching 'sadtler spectra'. All indexes are in print format and filed in Lockwood Book Collection QC453.S27. Print spectra and indexes are housed in green bound volumes or loose leaf binders.

Sadtler is our most extensive set of actual spectra covering IR, FTIR, NMR, C-13 NMR, DTA, ATR IR, and UV. There are alphabetical, molecular formula, chemical class, and chemical weight indexes, and supplements. Each collection is listed separately in this guide under the appropriate heading(s).

* SDBS Integrated Spectral Data Base System for Organic Compounds

Downloadable spectra ; Compound Dictionary (30,000 compounds);
MS (ca 19,600 spectra); 13C NMR (ca 11,000 spectra);
1H NMR (ca 13,500 spectra); ESR (ca 2,000 spectra);
IR (ca 47,300 spectra); Raman (ca 3,500 spectra)

* Sigma-Aldrich On-line Product Catalog
http://www.sigmaaldrich.com/Area_of_Interest/The_Americas/United_States.html
Provides FT-NMR, FT-IR, and FT-Raman IR for many of their products.

Spectrometric identification of organic compounds / Robert M. Silverstein
6th ed. New York: Wiley, 1998.
Lockwood Book Collection QD272 .S6 S55 1998
Basic text. Older editions back to 1967 also available, but may be checked out.

Tables of spectral data for structure determination of organic compounds
Berlin; New York: Springer-Verlag, c1989
Lockwood Book Collection QC462.85 .T313 1989
Covers C-13 NMR, Proton NMR, IR, Mass, and UV/Vis spectra.

Thermodynamic Research Center (TRC) Selected Spectral Data and API-44 spectra [a special project of the TRC for the American Petroleum Institute (API)] include substances that are principally hydrocarbons and their oxygen, halogen, sulfur and nitrogen derivatives. The set, filed in various places in the Lockwood Periodicals collection, includes IR, Mass, Raman, UV, proton NMR, and C-13 NMR spectra. The NMR collections also contain data covering silicon substances. A few organometallic and organophosphorus compounds are included. Use the electronic TRC Comprehensive Index CD-ROM workstation in Lockwood Reference area to determine if a compound is covered in the TRC or API-44 spectral collections.

* USGS Digital Spectral Library
http://speclab.cr.usgs.gov/spectral-lib.html
Contains 800+ UV/Near-IR spectra of minerals, mixtures, artificial, liquids and volatiles and vegetation, each with documentation.

Atomic & Microwave Spectra

* Atomic Spectra Database (ASD) [NIST]
http://physics.nist.gov/cgi-bin/AtData/main_asd
Radiative transitions and energy levels in atoms and atomic ions for observed transitions of 99 elements and energy levels of 52 elements.

* Diatomic Spectral Database [NIST]
http://physics.nist.gov/PhysRefData/MolSpec/Diatomic/index.html
All of the rotational spectral lines observed and reported in the open literature for 121 diatomic molecules have been tabulated. The isotopic molecular species, assigned quantum numbers, observed frequency, estimated measurement uncertainty, and reference are given for each transition reported.

Handbook of Basic Atomic Spectroscopic Data [NIST]
http://physics.nist.gov/PhysRefData/Handbook/index.html
The compilation includes data for the neutral and singly-ionized atoms of all elements hydrogen through einsteinium (Z = 1-99). The wavelengths, intensities, and spectrum assignments are given in a table for each element, and the data for the approximately 12,000 lines of all elements are also collected into a single table, sorted by wavelength (a "finding list").

Microwave Molecular Spectra, 3rd ed. (UB Knovel Subscription)    Extensive descriptive information, theory, and examples.

MIT wavelength tables.
Cambridge, Mass. : M.I.T. Press, -c1982 2 v.
Lockwood Science & Engineering Reference QC453 .M36 1969
Intensities in arc, spark, or discharge tube of more than 100,000 spectrum lines most strongly emitted by the atomic elements under normal conditions of excitation between 10,000 A. and 2000 A., arranged in order of decreasing wavelengths

* Triatomic Spectral Database [NIST]
http://physics.nist.gov/PhysRefData/MolSpec/Triatomic/index.html
All of the rotational spectral lines observed and reported in the open literature for 55 triatomic molecules have been tabulated. The isotopic molecular species, assigned quantum numbers, observed frequency, estimated measurement uncertainty and reference are given for each transition reported.

Differential Thermal Analysis (DTA)

* Sadtler DTA STANDARD Spectra
2,000 DTA (differential thermal analysis) spectra (#D1-#D2,000)
Lockwood Microform Area QD079.T38
Print Index: Lockwood Periodicals QC453.S28 Total Spectra Index [1976]

* Sadtler DTA Polymers COMMERCIAL Spectra
700 DTA (differential thermal analysis) spectra (#D1-#D700)
Lockwood Microform Area QC457.S34 Reel 4
Print Index: Lockwood Periodicals QC453.S27 General Index [1966]

Infrared Spectra (IR) (See also Spectra by Material Class.)

* Aldrich library of FT-IR spectra / Charles J. Pouchert
Milwaukee, Wis. : Aldrich Chemical Co., c1985. 2 v
Lockwood Science & Engineering Reference QD96.I5 P66 1985
Condensed phase IR spectra, arranged by chemical class and complexity. Indexes by name, molecular formula, & CAS registry number. 11,000 compounds.

* Aldrich library of infrared spectra / Charles J. Pouchert
2d ed. Milwaukee : Aldrich Chemical Co., c1975.
Lockwood Science & Engineering Reference QC457 .P65 1975
Alphabetical and MF indexes

* API-44 Selected infrared spectral data. Tables
Washington, D.C.: American Petroleum Institute Research Project 44
Lockwood Science & Engineering Reference QD856 .S5 T728 serial no.1-serial no.3650

* Atlas of polymer and plastics analysis
Munich; Hanser; Weinheim; Deerfield Beach, FL: Verlag Chemie, 1978-
Lockwood Science & Engineering Reference QD139 .P6 H8 1978
Primarily infrared spectra.

Characteristic frequencies of chemical groups in the infra- red.
Amsterdam, New York, Elsevier Pub. Co., 1963.
Lockwood Book Collection QC457 .F53

* Coblentz Society desk book of infrared spectra
2nd ed. Kirkwood, MO (P.O. Box 9952, Kirkwood 63122) : The Society, 1982, c1977
Lockwood Science & Engineering Reference QC457 .C687 1982
IR grating spectra of 1700 compounds.

* Coblentz Society Infrared Spectra Collection (Sadtler)
10,000 IR prism & grating spectra (#1-#10,000)
Lockwood Microform Area QC457.S34 Reel 2
Print Index: Lockwood Science & Engineering Reference QC453.S28 Total Spectra Index [1976]

* Handbook of infrared and Raman spectra of inorganic compounds and organic salts
San Diego : Academic Press, c1997. V.1-4
Lockwood Science & Engineering Reference QC457 .N93 1997

Index of vibrational spectra of inorganic and organometallic compounds
London, Butterworths, 1972-
Lockwood Science & Engineering Reference QC453 .G742 v.3.
25,000 compounds, IR and Raman, spectra not included

* Infrared (2.1-25 um) spectra of minerals / John W. Salisbury
Baltimore : John Hopkins University Press, 1991.
Lockwood Science & Engineering Reference QE369 .S65 I538 1991

Infrared absorption spectra; index.
New York : Academic Press
1945/57-1958/62
Lockwood Book Collection Z7144.S7 I6
36,000 references for organic and inorganic compounds, chemical substance index, spectra not included.

Infrared and Raman spectra of inorganic and coordination compounds
New York : Wiley, c1997. 5th ed.
Lockwood Book Collection QD96.I5 N33 1997 Parts A&B

Infrared band handbook
New York, Plenum Press, 1963.
Lockwood Science & Engineering Reference QC457 .S98 1963
27,000 bands, spectra not included

Infrared and Raman characteristic group frequencies: tables and charts
Chichester : J. Wiley, 3rd ed., 2001.
Lockwood Science & Engineering Reference QC457... - On order as of 9/9/2004.

* Infrared spectra and characteristic frequencies 700-300 cm-1
New York, Interscience
Lockwood Science & Engineering Reference QC457 .B49 1968
collection of 1566 organic and inorganic spectra, interpretation, and bibliography

* Infrared spectra handbook of priority pollutants and toxic chemicals
Philadelphia, Pa. : Sadtler Research Laboratories, c1982.
Lockwood Science & Engineering Reference QC457 .I527 1982

* Interpreted infrared spectra
New York, Plenum Press, 1964-
Lockwood Book Collection QD95 .S97 v.1-v.3

* MCA Selected infrared spectral data.
Pittsburgh : Manufacturing Chemists' Association Research Project
Lockwood Science & Engineering Reference QD85 .S5 T729 serial no.1 (1959:Dec.31)-serial no.1530 (1983:June 30)

* Merck FT-IR Atlas : eine Sammlung von FT-IR Spektren = a collection of FT-IR spectra
Weinheim (Federal Republic of Germany) ; New York : VCH, c1987-
Lockwood Science & Engineering Reference QC457 .M473 1988

* Rapra Collection of Infrared Spectra of Rubbers, Plastics, and Thermoplastic Elastomers (3rd Edition) (UB Knovel Subscription)
Lockwood Science & Engineering Reference QC463 .P5.S53 1997 (2nd Edition)
Transmission and pyrolysate spectra of a comprehensive range of technically important rubber and plastic materials.

* Sadtler infrared grating STANDARD spectra
2-15 microns. 90,977 spectra (#1K-#90,977K)
Lockwood Microform Area: QC457.S3
Print Indexes: Lockwood Periodicals QC453.S28....

* Sadtler infrared prism STANDARD spectra
2-15 microns 49,000 IR prism spectra
Lockwood Microform Area: QC457.S328 (#1-#37,000)
Lockwood Science & Engineering Reference QC453 S28 Infrared Prism. Vol. 37-48 (#37,001-#49,000)
Print Indexes: Lockwood Periodicals QC453.S28....

Tables of molecular vibrational frequencies. Consolidated Volume 1.
Washington, National Bureau of Standards; U.S. Govt. Print. Off.,1972.
Lockwood Book Collection QC100 .U573 no.39
Supersedes Tables of molecular vibrational frequencies , NSRDS-NBS-6, part 1; NSRDS-NBS-11, part 2; and NSRDS-NBS-17, part 3.

* Tabulation of infrared spectral data
New York : Wiley, c1977.
Lockwood Science & Engineering Reference QC457 .D64

* TRC Spectral Data - Infrared
College Station, Tex: Thermodynamics Research Center, Texas A & M University System, 1985-
Lockwood Periodicals QD85 .S5 T73 v.1-v.6

Mass Spectra (MS)

* API-44 Selected mass spectral data. Tables
Washington, D.C. : National Bureau of Standards
Lockwood Periodicals QD85 .S5 T758 1976-1983

* Handbook of mass spectra of environmental contaminants
2nd ed. Boca Raton : Lewis Publishers, c1992.
Lockwood Science & Engineering ReferenceTD193 .H57 1992

* EPA/NIH mass spectral data base
: U.S. Dept. of Commerce, National Bureau of Standards, GPO, 1978-
Lockwood Science & Engineering Reference QC100 .U573 no.63 V.1-5
Supplements are on microfiche SCI/ENGR Microform Area US MicFiche C 13.48: 63
Data are entered by increasing molecular weight.

* Ion mass spectra
New York, Wiley
Lockwood Book Collection QC454.M3 W54

MassSpectator Online Calculator: Advanced Synthetic Polymer Mass Spectral Data Analysis (NIST)
http://www.ctcms.nist.gov/cgi-bin/MassSpectator.pl
Calculates the area beneath peaks from mass spectra

Mass spectral correlations
Washington, D.C. : American Chemical Society, 1982.
Lockwood Book Collection QD1 .A355 NO.40

Selected mass spectral data.
Pittsburgh : Carnegie Institute of Technology
Lockwood Science & Engineering Reference QD85 .S5 T759 v.1-v.2

* TRC spectral data - Mass
College Station, Tex: Thermodynamics Research Center, Texas A & M University System, 1985-
Lockwood Periodicals QD85 .S5 T76 v.1-v.5

* Wiley/NBS registry of mass spectral data
New York : Wiley, c1989.
Lockwood Science & Engineering Reference QC454.M3 M395 1989. V. 1-7.
A combination of the revisions of the following two books and their data base versions: Registry of mass spectral data by Einar Stenhagen, Sixten Abrahamsson, and Fred W. McLafferty; and
EPA/NIH mass spectral data base by S.R. Heller and G.W.A. Milne; and its two supplements
This edition is a little hard on the eyes, but contains more spectra.

NMR Spectra -Proton (See also Spectra by Material Class Tabs)

* Aldrich library of NMR spectra
Ed. 2. Milwaukee, Wis. (P.O. Box 355, Milwaukee 53201) : Aldrich Chemical Co., c1983. 2 v.
Lockwood Science & Engineering Reference QD96.N8 P68 1983
37,000 spectra indexed by name, molecular formula.

* Aldrich library of 13C and 1H FT NMR spectra
Milwaukee, Wis. : Aldrich Chemical Co., c1993. 3 v.
Lockwood Science & Engineering Reference QC454.F7 A4 1993
12,000 compounds, indexed by name, molecular formula, CAS reg. no

Annual Reports on NMR Spectroscopy
London; New York : Academic Press, 1968+
Lockwood Book Collection QC762.A46

* API-44 Selected nuclear magnetic resonance spectral data. 100 MHz
Thermodynamics Research Center API44 Hydrocarbon Project.
College Station, Texas : Thermodynamics Research Center, Texas
Engineering Experiment Station, Texas A&M University
Lockwood Periodicals QD85 .S5 T768b serial no.1 (1968:April 30)-serial no.464 (1982:April 30)

Handbook of NMR spectral parameters : tabulated high resolution chemical shifts and coupling constants for organic compounds according to spin system
London : Philadelphia : Heyden, c1979
Lockwood Science & Engineering Reference QC490 .B82 v.1-3

Handy and systematic catalog of NMR spectra : instruction through examples
Mill Valley, Calif. : University Science Books, c1980.
Lockwood Science & Engineering Reference QC762 .A94

NMR data on organic metal carbonyl complexes (1965-71) / P.W. Hickmott
Annual reports on NMR spectroscopy v. 6c, 1977.
Lockwood Book Collection QC762 .A46
3000 compounds, by metal complex, then by ligands.

NMR data tables for organic compounds
New York, Interscience Lockwood Book Collection QC762 .B6 v.1

* NMRShiftDB
http://www.nmrshiftdb.org
Freely available content. Allows for spectrum prediction (currently only for carbon) as well as for searching spectra, structures and other properties. Currently, 13C, 1H, 15N and 31P NMR shift data can be stored.

* NMR spectra catalog
1962-63. 2 v.
Lockwood Science & Engineering Reference QC762 .V27
chiefly tables, 700 charts.

Nuclear magnetic resonance spectra and chemical structure
v. 1. The spectral NMR parameters of compounds with analyzed spectra.

New York, Academic Press, 1967-
Lockwood Science & Engineering Reference QD476 .B78 (88 by compound name)

* Sadtler guide to NMR spectra
Philadelphia, Sadtler Research Laboratories, 1972.
Lockwood Science & Engineering Reference QC490 .S55

* Sadtler Nuclear magnetic resonance STANDARD Spectra (60 MHz)
64,000 60-MHz spectra (#1M-#64,000M)
Lockwood Microform Area QC451.S2
Print Indexes: Lockwood Periodicals QC453.S28....

* Sadtler Nuclear magnetic resonance STANDARD Spectra (100 MHz)
228 100-MHz spectra (#1Z-#228Z)
Lockwood Periodicals QC451.S28 Standard NMR Supplement. 1 vol.
Index in binder with spectra.

* Sadtler Nuclear magnetic resonance STANDARD Spectra (300 MHz)
4,000 300-MHz spectra (#H1B-#H4,000B)
Lockwood Microform Area QC762.S33
Print Indexes: Lockwood Science & Engineering Reference QC453.S28....

* TRC Selected nuclear magnetic resonance spectral data. 100 MHz
Thermodynamics Research Center Data Project.
College Station, Texas : Thermodynamics Research Center, Texas
Engineering Experiment Station, Texas A&M University
Lockwood Periodicals QD85 .S5 T768a Serial no.1 (1968:Dec.31)-serial no.735 (1982:Dec.31)

* TRC Selected nuclear magnetic resonance spectral data. 300 MHz
Thermodynamics Research Center Data Project.
College Station, Texas : Thermodynamics Research Center, Texas
Engineering Experiment Station, Texas A&M University
Lockwood Periodicals QD85 .S5 T769 serial no.1 (1975:Dec.31)-serial no.345 (1984:Nov.30)

* TRC spectral data. ¹H NMR
College Station, Tex: Thermodynamics Research Center, Texas A & M University System, 1985-
Lockwood Periodicals QD85 .S5 T77 v.1-v.5


NMR Spectra (Elements other than Hydrogen)

* Aldrich library of 13C and 1H FT NMR spectra
Milwaukee, Wis. : Aldrich Chemical Co., c1993. 3 v.
Lockwood Science & Engineering Reference QC454.F7 A4 1993
12,000 compounds, indexed by name, molecular formula, CAS registry number.

Annual Reports on NMR Spectroscopy
London; New York : Academic Press, 1968+
Lockwood Book Collection QC762.A46

* API-44 Selected ¹³C nuclear magnetic resonance spectral data.
[S.l.] : American Petroleum Institute Research Project 44
Lockwood Periodicals QD85 .S5 T778 1976-1984. V. 1-3.

Atlas of carbon-13 NMR data
London ; Philadelphia : Heyden, 1979 3 v.
Lockwood Science & Engineering Reference QC462.C1 B73 1979
NMR data compiled from the literature (3000 )

* Carbon-13 NMR spectra; a collection of assigned, coded and indexed spectra
New York, Wiley-Interscience
500 spectra
Lockwood Science & Engineering Reference QC462.C4 J64

Compilation of reported F 19 NMR chemical shifts, 1951 to mid-1967
New York, Wiley-Interscience
4,700 F-19 NMR data
Lockwood Book Collection QC462.F5 D8 1970

Fluorine-19 NMR spectroscopy / V. Wray
Annual reports on NMR spectroscopy v. 10b 1980
6,000 F-19 NMR data
Lockwood Book Collection QC762 .A46

* NMRShiftDB
http://www.nmrshiftdb.org
Freely available content. Allows for spectrum prediction (currently only for carbon) as well as for searching spectra, structures and other properties. Currently, 13C, 1H, 15N and 31P NMR shift data can be stored.

* Sadtler C-13 NMR STANDARD spectra
39,000 spectra (#1C-#39,000C)
Lockwood Microform Area: QC462.C4
Print Indexes: Lockwood Periodicals QC453.S28....

* TRC spectral data. 13C NMR
College Station, Tex: Thermodynamics Research Center, Texas A & M University System, 1985-
Lockwood Periodicals QD85 .S5 T78 v.1-v.4

Raman Spectra

* Handbook of infrared and Raman spectra of inorganic compounds and organic salts

San Diego : Academic Press, c1997. V.1-4
Lockwood Science & Engineering Reference QC457 .N93 1997

 

Infrared and Raman spectra of inorganic and coordination compounds
New York : Wiley, c1986. 4th ed.
Lockwood Book Collection QD96.I5 N33 1986

* MCA Selected Raman spectral data.
Pittsburgh : Manufacturing Chemists' Association Research
Project, Carnegie Institute of Technology
Lockwood Periodicals QD85 .S5 T788 serial no.1-serial no.113

* Selected Raman spectral data.
Washington, D.C. : National Bureau of Standards
Lockwood Science & Engineering Reference QD85 .S5 T789 serial no.1-serial no.935

* TRC spectral data - Raman.
College Station, Tex: Thermodynamics Research Center, Texas A & M University System, 1985-
Lockwood Periodicals QD85 .S5 T79 v.1-v.4

Ultraviolet and Visible Spectra

* Absorption spectra in the ultraviolet and visible region.
New York, Academic Press 1959-
Lockwood Book Collection QC437 .L26 v.1-23
Indexes for each volume, and cumulative.

* API-44 Selected ultraviolet spectral data. Tables
Pittsburgh : Carnegie Institute of Technology
Lockwood Periodicals QD85 .S5 T738 1975-1985. V. 1-4.

* Atlas of protein spectra in the ultraviolet and visible regions.
New York, IFI/Plenum, 1972-
Lockwood Book Collection QC463.P7 K5 v.1

Handbook of Ultraviolet and Visible Absorption Spectra of Organic Compounds
New York : Plenum Press Data Division, 1967
Lockwood Book Collection QD291.H5

* MCA Selected ultraviolet spectral data.
Pittsburgh : Manufacturing Chemists' Association
Lockwood Science & Engineering Reference QD85 .S5 T739 vol. 1

Organic electronic spectral data.
New York : Wiley & Sons 1946/52-
Lockwood Science & Engineering Reference QC437.O73, v.1 (1946/1952)-v.9 (1967), v.24 (1982)
Data abstracted from the journal literature for each year, which see. (references)

* Sadtler Ultraviolet STANDARD Spectra
23,278 spectra (#1UV-#23,278UV)
Lockwood Science & Engineering Reference QC453 S28 Standard UV. Vol. 1-86
Print Indexes: Lockwood Periodicals QC453.S28....

* TRC spectral data - Ultraviolet
College Station, Tex: Thermodynamics Research Center, Texas A & M University System, 1985-
Lockwood Periodicals QD85 .S5 T74 v.1-v.5

Ultraviolet and visible absorption spectra. Index.
New York, Academic Press. 1930/54-
Lockwood Book Collection Z7144.S7 H4 1930/1954 - 1960/1963

Ultraviolet multiplet table / Moore
Washington, DC: U.S. Govt. Print. Off., 1950-
Lockwood Book Collection QC100 .U555 no.488

* UV atlas of organic compounds
London: Butterworths, 1966-
Lockwood Science & Engineering Reference(Non-Circulating) QC459 .U85 v.1-5.
Cumulative MF, alphabetic, and compound classification indexes in v. 5.

X-ray Crystallography/Spectra

* American Mineralogist Crystal Structure Database
http://www.geo.arizona.edu/AMS/amcsd.php
Access to every structure published in American Mineralogist, The Canadian Mineralogist, and the European Journal of Mineralogy. Data from the Physics and Chemistry of Minerals is in the process of being added.

*Bilboa Crystallographic Server [Materials Lab, Univ. of Basque Country, Spain] http://www.cryst.ehu.es/
A wide ranging collection of programs, retrieval tools, and databases including the Incommensurate Structures Database.

* Cambridge Structural Database (CSD) Teaching Database)

http://www.ccdc.cam.ac.uk/Community/educationalresources/csdteachingdatabase/

733 freely available structures for use in educational settings.

* CPDS Powder Diffraction File
Swarthmore, Pa. : JCPDS, International Centre for Diffraction Data, 1980-
INDEX ONLY: Lockwood Science & Engineering Reference QC482 .D5 P643
Diffraction patterns available on CDROM in the UB Geology Dept. by contacting Dr. Ross Giese glgclay@buffalo.edu.

* Crystallography Open Database
http://www.crystallography.net/
Over 360,000 structures contributed by researchers worldwide. A separate database of predicted structures is also available.

Data Activities in Crystallography (IUCr)
http://www.iucr.org/resources/data
Directory of fee-based and free crystallography databases, formats and related information

* Database of Zeolite Structures [International Zeolite Association]
http://www.iza-structure.org/databases/

* Inorganic Material Database (AtomWork)  - http://crystdb.nims.go.jp/index_en.html

 Basic crystal structure, x-ray diffraction, poperty and phase diagram data of inorganic and metallic materials from main literature sources. Over 82,000 crystal structures. Free with registration.

Mineralogy Database
http://webmineral.com/
Over 4,700 individual mineral species descriptions linked to crystallography, X-Ray powder diffraction, chemical composition, properties, Dana's New classification, and Strunz classification.

* Reciprocal Net
http://www.reciprocalnet.org/
A cooperative effort of various crystallography research labs which is part of the National Science Digital Library funded by NSF.

X-ray Photoelectron Spectroscopy Database [NIST]
http://srdata.nist.gov/xps/
Access to the energies of many photoelectron and Auger-electron spectral lines. Resulting from a critical evaluation of the published literature, the database contains over 22,000 line positions, chemical shifts, doublet splittings, and energy separations of photoelectron and Auger-electron lines.

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Amanda McCormick
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