4,5-Diphenoxybenzene-1,2-dicarbo-nitrile

Chuan Ching Foo; Ai Ling Tan; Franz L. Wimmer; Aminul Huq Mirza; David J. Young; Seik Weng Ng; Edward R T Tiekink

doi:10.1107/S1600536812004060

4,5-Diphenoxybenzene-1,2-dicarbo-nitrile

Chuan Ching Foo, Ai Ling Tan, Franz L. Wimmer, Aminul Huq Mirza, David J. Young, Seik Weng Ng, Edward R T Tiekink

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Abstract

In the title compound, C ₂₀H ₁₂N ₂O ₂, the phenyl and benzene rings are mutually perpendicular, with the dihedral angle between the phenyl rings being 87.92 (16)° and those formed between the phenyl rings and the benzene rings being 73.68 (15) and 84.65 (15)°. Helical supramolecular chains along [010], mediated by C - H⋯N interactions, are found in the crystal structure.

Original language	English
Pages (from-to)	o601-o601
Number of pages	1
Journal	Acta Crystallographica Section E: Structure Reports Online
Volume	E68
Issue number	Part 3
DOIs	https://doi.org/10.1107/S1600536812004060
Publication status	Published - 1 Mar 2012
Externally published	Yes

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10.1107/S1600536812004060Licence: CC BY

22658070-oaFinal published version, 331 KBLicence: CC BY

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Foo, C. C., Tan, A. L., Wimmer, F. L., Mirza, A. H., Young, D. J., Ng, S. W., & Tiekink, E. R. T. (2012). 4,5-Diphenoxybenzene-1,2-dicarbo-nitrile. Acta Crystallographica Section E: Structure Reports Online, E68(Part 3), o601-o601. https://doi.org/10.1107/S1600536812004060

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abstract = "In the title compound, C 20H 12N 2O 2, the phenyl and benzene rings are mutually perpendicular, with the dihedral angle between the phenyl rings being 87.92 (16)° and those formed between the phenyl rings and the benzene rings being 73.68 (15) and 84.65 (15)°. Helical supramolecular chains along [010], mediated by C - H⋯N interactions, are found in the crystal structure.",

keywords = "data-to-parameter ratio = 9.4, mean σ(C-C) = 0.005 {\AA}, R factor = 0.054, single-crystal X-ray study, T = 100 K, wR factor = 0.118",

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T1 - 4,5-Diphenoxybenzene-1,2-dicarbo-nitrile

AU - Foo, Chuan Ching

AU - Tan, Ai Ling

AU - Wimmer, Franz L.

AU - Mirza, Aminul Huq

AU - Young, David J.

AU - Ng, Seik Weng

AU - Tiekink, Edward R T

PY - 2012/3/1

Y1 - 2012/3/1

N2 - In the title compound, C 20H 12N 2O 2, the phenyl and benzene rings are mutually perpendicular, with the dihedral angle between the phenyl rings being 87.92 (16)° and those formed between the phenyl rings and the benzene rings being 73.68 (15) and 84.65 (15)°. Helical supramolecular chains along [010], mediated by C - H⋯N interactions, are found in the crystal structure.

AB - In the title compound, C 20H 12N 2O 2, the phenyl and benzene rings are mutually perpendicular, with the dihedral angle between the phenyl rings being 87.92 (16)° and those formed between the phenyl rings and the benzene rings being 73.68 (15) and 84.65 (15)°. Helical supramolecular chains along [010], mediated by C - H⋯N interactions, are found in the crystal structure.

KW - data-to-parameter ratio = 9.4

KW - mean σ(C-C) = 0.005 Å

KW - R factor = 0.054

KW - single-crystal X-ray study

KW - T = 100 K

KW - wR factor = 0.118

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JO - Acta Crystallographica Section E: Crystallographic Communications

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