𝔖 Bobbio Scriptorium
✦   LIBER   ✦

Microcomputer-based modeling and simulation

✍ Scribed by Vinay K. Vasudev; William E. Biles


Publisher
Elsevier Science
Year
1986
Tongue
English
Weight
402 KB
Volume
24
Category
Article
ISSN
0377-2217

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The empirical prediction of =C NMR chemical shifts using the Lindeman-Adams rules and substituent chemical shift parameters is a useful aid for the chemist in the interpretation of spectra. The program Alkanes, written in Basic for a desk-top microcomputer, automates the chemical shift estimation.