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Crystal and molecular structure of 2,6-bis(4-chlorophenyl)-3-phenylpiperidin-4-one

Ompraba, G and Srinivasan, M and Perumal, S and Sekar, K and Choudhury, AR and Row, Guru TN and Rafi, ZA (2003) Crystal and molecular structure of 2,6-bis(4-chlorophenyl)-3-phenylpiperidin-4-one. In: Crystal Research and Technology, 38 (10). pp. 918-921.

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The crystal structure of the title compound is described. The chemical formula of the compound is $C_2_3H_1_9C_l_2NO$. The compound is found to crystallize in monoclinic system with space group $P2_1$/c, Z = 4. The unit cell dimensions are a = 15.137(3) $\AA$, b = 8.9171(18) $\AA$, c = 14.779(3) $\AA$, \beta = 91.461(4)° and V = 1994.2(7) $\AA$ 3, Dcalc = 1.320 $gcm^{-3}$. The final R factor is 4.4%. The central piperidone ring of the molecule adopts a slightly distorted chair conformation, the mean torsion angle being 52.3°; the phenyl rings are planar.

Item Type: Journal Article
Publication: Crystal Research and Technology
Publisher: WILEY-VCH Verlag GmbH & Co. KGaA, Weinheim
Additional Information: The copyright belongs to WILEY-VCH Verlag GmbH & Co. KGaA, Weinheim.
Keywords: Piperidone;Bactericidal;Fungicidal;Herbicidal
Department/Centre: Division of Interdisciplinary Sciences > Supercomputer Education & Research Centre
Division of Chemical Sciences > Solid State & Structural Chemistry Unit
Division of Information Sciences (Doesn't exist now) > BioInformatics Centre
Date Deposited: 28 Mar 2006
Last Modified: 27 Aug 2008 11:51
URI: http://eprints.iisc.ac.in/id/eprint/6145

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