Single-crystal X-ray study T = 153 K Mean '(C±C) = 0.002 A Ê R factor = 0.039 wR factor = 0.116 Data-to-parameter ratio = 17.0 For details of how these key indicators were automatically derived from the article, see http://journals.iucr.org/e.
Methyl exo-bicyclo[3.1.0]hexane-6,6-dicarboxylate
✍ Scribed by Yufit, Dmitrii S. ;Bagutskii, Viktor ;Howard, Judith A. K. ;Meijere, Armin de
- Publisher
- International Union of Crystallography
- Year
- 2003
- Tongue
- English
- Weight
- 419 KB
- Volume
- 59
- Category
- Article
- ISSN
- 1600-5368
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✦ Synopsis
The bicyclo[3.1.0]hexane fragment of the title molecule, C 9 H 12 O 4 , adopts a boat-like conformation, with its methoxycarbonyl substituent in the endo position. In the crystal structure, molecules form centrosymmetric OÐHÁ Á ÁO hydrogen-bonded dimers, which are arranged in layers.
📜 SIMILAR VOLUMES
In the title molecule, C 24 H 20 N 2 O 5 , the cyclohexene ring adopts a half-chair conformation. The molecular structure shows some intra-and intermolecular hydrogen bonds.
The molecular structure of (I), showing 30% probability displacement ellipsoids and the atom-numbering scheme.
Reaction between cyclopentene and chlorocarbene (1) in ether solution at 20' gave exo--and endo-6-chlorobicyclo[j.l.O!hexanes (I and II, respectively), in ~a. 35% combined yields. The more abundant isomer (~a. 75% of the mixture) was isolated by preparative g.l.c., and characterized as a chlorocarbe
Single-crystal X-ray study T = 298 K Mean '(C±C) = 0.007 A Ê Disorder in main residue R factor = 0.042 wR factor = 0.101 Data-to-parameter ratio = 9.4 For details of how these key indicators were automatically derived from the article, see http://journals.iucr.org/e.