Structure-property relationships of prototypical chiral compounds: Case studies
2004 | journal article. A publication with affiliation to the University of Göttingen.
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Details
- Authors
- Rinderspacher, B. Christopher; Schreiner, Peter R.
- Abstract
- Empirical rules based on chromophores, although beautifully simple, turn out to be too constrained to be of general use. This computational study of selected 3-methylhexane and camphor derivatives demonstrates the limitations of focusing on chromophores. We conclude that in a hybrid of experiment and theoretical computation lies the future of determining absolute configurations.
- Issue Date
- 2004
- Status
- published
- Publisher
- Amer Chemical Soc
- Journal
- The Journal of Physical Chemistry A
- ISSN
- 1089-5639
