Single-crystal X-ray study T = 296 K Mean '(C±C) = 0.003 A Ê R factor = 0.034 wR factor = 0.099 Data-to-parameter ratio = 7.0 For details of how these key indicators were automatically derived from the article, see http://journals.iucr.org/e.
3-(Dicyanomethylene)-1,5-diphenylpenta-1,4-diyne
✍ Scribed by Jones, Peter G. ;Hopf, Henning ;Kreutzer, Martin
- Publisher
- International Union of Crystallography
- Year
- 2002
- Tongue
- English
- Weight
- 299 KB
- Volume
- 58
- Category
- Article
- ISSN
- 1600-5368
No coin nor oath required. For personal study only.
✦ Synopsis
The molecule of the title compound, C 20 H 10 N 2 , displays no imposed symmetry, but is largely planar [one phenyl ring is twisted by 10.4 (1) out of the plane of the rest of the molecule]. The central C C bond length is 1.371 (3) A Ê . The molecules are linked by a weak hydrogen bond of the form CÐHÁ Á ÁN.
📜 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.
Single-crystal X-ray study T = 152 K Mean '(C±C) = 0.004 A Ê R factor = 0.044 wR factor = 0.141 Data-to-parameter ratio = 7.1 For details of how these key indicators were automatically derived from the article, see http://journals.iucr.org/e.
Single-crystal X-ray study T = 293 K Mean '(C±C) = 0.005 A Ê R factor = 0.057 wR factor = 0.204 Data-to-parameter ratio = 14.9 For details of how these key indicators were automatically derived from the article, see http://journals.iucr.org/e.