By Lisa Sabin-Wilson
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Launch a WordPress.com web publication In an afternoon For Dummies is the fast and simple solution to sign up for the blogosphere with WordPress.com.
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Lampman, George S. W. Robinson (CRC Press: 1991) See the handout for a listing of newer and useful encyclopedias, texts and internet sites. chem. edu/lib/noble/chem/ SLIDE 40 Other Interesting tidbits Local spectroscopy experts Instruments (Perkin-Elmer, Nicolet) with built in libraries “Spectral Data” in Protein Databank Don’t feel like you always have to know all the answers. I found a few spectroscopy experts on my campus and I bet your organization ha s some too. Also note that many instruments are coming with built in spectra libraries.
33 BioRad’s HaveItAlltm >500,000 high quality reference spectra on CD 4 major spectra sets NMR: ~12,000 HNMR & ~147,000 CNMR IR: ~230,000 IR & ~3,800 NEAR IR, Raman: ~3,300 MS: ~107,000 (NIST) Includes structures and experimental conditions Can build collections for multiple techniques such as UV/VIS, GC, IR, 13C NMR, H NMR, Raman, NIR, MS Easy to move between techniques Databases available by subscription HaveitAll is the database portion of BioRad’s offering. They have a very large, high quality spectra collection which includes SLIDE If you are looking at the data for one compound, it is easy to bring up all the available information, including spectra generated using various techniques.
Gov/ Size IR: ~8700 compounds. MS: ~12,000 compounds. UV/Vis: ~400 compounds. Electronic and vibrational spectra: ~4000 compounds. Search by: name, chemical formula, CAS registry number, molecular weight, chemical structure, or selected ion energetics and spectral properties. Part of the Standard Reference Data Program Free The NIST Web book is another free web resource. It contains a small collection of Spectra. There are many ways to search, including SLIDE. 35 Chemical Concept’s SpecInfo Three products: SpecInfo Inhouse, SpecData, SpecInfo Internet Features: Build an internal database, match spectra, predict NMR shifts: carbon and protons, elucidation, structure drawing, reports Search By: Structure, substructure, chemical name, MW, MF, CAS RN Also available on STN – 194,000 spectra Another major player in spectra software and libraries is Chemical Concepts, a Wiley company.