3-(2,3-Dioxoindolin-1-yl)propanenitrile

被引:3
|
作者
Qachchachi, Fatima-Zahrae [1 ]
Rodi, Youssef Kandri [1 ]
Essassi, El Mokhtar [2 ]
Bodensteiner, Michael [3 ]
El Ammari, Lahcen [4 ]
机构
[1] Univ Sidi Mohamed Ben Abdallah, Fac Sci & Techn, Lab Chim Organ Appl, Route Immouzzer,BP 2202, Fes, Morocco
[2] Univ Mohammed Agdal, Lab Chim Organ Heterocycl, URAC 21, Pole Competences Pharmacochimie, Rabat, Morocco
[3] Univ Regensburg, X Ray Struct Anal Unit, D-93053 Regensburg, Germany
[4] Univ Mohammed Agdal, Fac Sci, Lab Chim Solide Appl, Rabat, Morocco
来源
ACTA CRYSTALLOGRAPHICA SECTION E-CRYSTALLOGRAPHIC COMMUNICATIONS | 2014年 / 70卷
关键词
Data-to-parameter ratio = 13.1; Mean σ(C-C) = 0.002 Å; R factor = 0.033; Single-crystal X-ray study; T = 123 K; wR factor = 0.086;
D O I
10.1107/S1600536814003985
中图分类号
O7 [晶体学];
学科分类号
0702 ; 070205 ; 0703 ; 080501 ;
摘要
The asymmetric unit of the title compound, C11H8N2O2, contains two independent molecules (A and B). Each molecule is build up from fused five-and six-membered rings with the former linked to a cyanoethyl group. The indoline ring and two carbonyl O atoms of each molecule are nearly coplanar, with the largest deviations from the mean planes being 0.0198 (9) (molecule A) and 0.0902 (9) angstrom (molecule B), each by a carbonyl O atom. The fused ring system is nearly perpendicular to the mean plane passing through the cyanoethyl chains, as indicated by the dihedral angles between them of 69.72 (9) (molecule A) and 69.15 (9)degrees (molecule B). In the crystal, molecules are linked by C-H center dot center dot center dot O and pi-pi [intercentroid distance between inversion-related indoline (A) rings = 3.6804 (7) angstrom] interactions into a double layer that stacks along the a-axis direction.
引用
收藏
页码:O361 / +
页数:9
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