๐”– Bobbio Scriptorium
โœฆ   LIBER   โœฆ

Calculation of heats of formation for carbocyclic compounds

โœ Scribed by A. I. Vitvitskii


Book ID
112361865
Publisher
Springer
Year
1969
Tongue
English
Weight
319 KB
Volume
3
Category
Article
ISSN
0040-5760

No coin nor oath required. For personal study only.


๐Ÿ“œ SIMILAR VOLUMES


Efficient Calculation of Heats of Format
โœ Ohlinger, W. S.; Klunzinger, P. E.; Deppmeier, B. J.; Hehre, W. J. ๐Ÿ“‚ Article ๐Ÿ“… 2009 ๐Ÿ› American Chemical Society ๐ŸŒ English โš– 135 KB
MINDO/3 Calculation of carbocation heats
โœ J. Milton Harris; Steven G. Shafer; S. D. Worley ๐Ÿ“‚ Article ๐Ÿ“… 1982 ๐Ÿ› John Wiley and Sons ๐ŸŒ English โš– 450 KB

## Abstract Heats of formation calculated by MINDO/3 are reported for 42 carbocations for which experimental heats of formation have been published. Errors associated with these calculations can be large, with an overall range of ยฑ13 kcal/mol. Correction of systematic errors in the MINDO/3 calculat