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Ab Initio Calculations of Conformational Effects on 13c NMR Spectra of Amorphous Polymers
Born, R.; Spiess, Hans Wolfgang. Ed(S): Seelig, J.
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Description for Ab Initio Calculations of Conformational Effects on 13c NMR Spectra of Amorphous Polymers
Paperback. Editor(s): Seelig, J. Series: NMR Basic Principles and Progress. Num Pages: 126 pages, biography. BIC Classification: PNF; PNN; PNNP; PNRP. Category: (P) Professional & Vocational. Dimension: 234 x 156 x 7. Weight in Grams: 224.
In NMR, it is well-known that the chemical shift conveys structural informa tion, e. g. a carbonyl carbon will have a resonance frequency appreciably dif ferent from a methyl carbon, etc. The relation between structure and chemical shift is mostly established by empirical rules on the basis of prior experience. It is only quite recently that the advent of both comparatively cheap comput ing power and novel quantum chemistry approaches have provided feasible routes to calculate the chemical shift at the ab initio level for molecules of reasonable size. This raises the question whether application of these novel theoretical concepts ... Read more
In NMR, it is well-known that the chemical shift conveys structural informa tion, e. g. a carbonyl carbon will have a resonance frequency appreciably dif ferent from a methyl carbon, etc. The relation between structure and chemical shift is mostly established by empirical rules on the basis of prior experience. It is only quite recently that the advent of both comparatively cheap comput ing power and novel quantum chemistry approaches have provided feasible routes to calculate the chemical shift at the ab initio level for molecules of reasonable size. This raises the question whether application of these novel theoretical concepts ... Read more
Product Details
Format
Paperback
Publication date
2011
Publisher
Springer-Verlag Berlin and Heidelberg GmbH & Co. KG Germany
Number of pages
126
Condition
New
Series
NMR Basic Principles and Progress
Number of Pages
126
Place of Publication
Berlin, Germany
ISBN
9783642644900
SKU
V9783642644900
Shipping Time
Usually ships in 15 to 20 working days
Ref
99-15
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