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Structure of (3aα,4α,7α,7aα)-2,2-dimethyl-3a,4,7,7a-tetrahydro-1,3-benzodioxolane-4,7-diamine

Authors :
M. F. Mackay
S. L. Richards
M. G. Banwell
Source :
Acta Crystallographica Section C Crystal Structure Communications. 49:556-558
Publication Year :
1993
Publisher :
International Union of Crystallography (IUCr), 1993.

Abstract

C 9 H 16 N 2 O 2 , M r =184.2, rhombohe dral, R3, a=12.594 (2) A, α=118.03 (1) o , V=720 (2) A 3 , Z=3, D x =1.274 Mg m -3 , A(Cu Kα)= 1.5418 A, μ=0.70 mm -1 , F(000)=300, T=290 (1) K, final R=0.047 for 1191 reflections with I ≥2σ(I). Although the title molecule (I) is a meso compound, it does not have exact mirror symmetry in the solid state. The observed distortions, which no doubt arise from the fusion of the two rings, results in two enantiomeric forms with any given crystal containing only the one enantiomer (e.g. with 3aS, 4R,7S,7aR configurations)

Details

ISSN :
01082701
Volume :
49
Database :
OpenAIRE
Journal :
Acta Crystallographica Section C Crystal Structure Communications
Accession number :
edsair.doi...........be8b0a0eb9f1741ed390d4260bbb2473
Full Text :
https://doi.org/10.1107/s0108270192007819