The conformation of 1,6-anhydrolactoase (1) has been investigated by n.m.r. spectroscopy and molecular mechanics calculations. For a solution in D2O, the 1,6-anhydroglucopyranoid ring has a 1C4 conformation, whereas there is a approximately 1:1 equilibrium between the 1C4 and the BO,3 conformations
The Conformation of 1,6-Diaza-2,7-cyclodecadione in Solution
โ Scribed by Tammo Winkler; Thomas Leutert
- Publisher
- John Wiley and Sons
- Year
- 1982
- Tongue
- German
- Weight
- 204 KB
- Volume
- 65
- Category
- Article
- ISSN
- 0018-019X
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โฆ Synopsis
Abstract
From ^1^Hโ and ^13^CโNMR. data, a crown conformation with trans amide bonds is deduced for 1,6โdiazaโ2,7โcyclodecadione (1) in solution. Compound 1 was obtained by reaction of 2โpyrrolidone with POCl~3~.
๐ SIMILAR VOLUMES
The conformational space of the 2-cyano-1,l-dihydroxyethane molecule was studied at the semi-empirical PM3 level and ab initio MP2/6-31G\*\*//6-31G level in the gas phase and in a low-polarity medium. This system has been chosen as a model compound for 2-cyanocyclohexanone propylene and ethylene ace
## Abstract A conformational equilibrium exists in solution between two skew forms (__s__^+^ and __s__^โ^) of [2.2]paracyclophane (1a). The vicinal coupling constants in the ^1^HโNMR spectra of the bridge protons in the six __ar__โmonosubstituted derivatives 1bโ1g (R๏ฃพCN, NO, Br, CH~3~, CHO, and NO~