13C NMR Chemical Shift Calculations for Some Substituted Pyridines: A Comparative Consideration
Author:
Affiliation:
1. Institut für Organische Chemie und Strukturanalytik, Universität Potsdam, Am Neuen Palais 10, D-14469 Potsdam, Federal Republic of Germany
Publisher
American Chemical Society (ACS)
Subject
Computational Theory and Mathematics,Computer Science Applications,Information Systems,General Chemistry
Link
https://pubs.acs.org/doi/pdf/10.1021/ci970440i
Reference51 articles.
1. Computer Application of an Incremental System for Calculating 13C NMR Spectra of Aromatic Compounds
2. A computer program for the prediction of 13-C-NMR chemical shifts of organic compounds
3. Comprehensive parameter set for the prediction of the 13C-NMR chemical shifts of sp3-hybridized carbon atoms in organic compounds
4. Parameter set for the prediction of the 13C-NMR chemical shifts of sp2- and sp-hybridized carbon atoms in organic compounds
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