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Crystal structures of two isomeric oximes. (EE)-2-methyl-3-phenyl-3-thiocyanatopropenaldoxime and (Z)-5-methyl-6-phenyl-1,3-thiazin-2-one oxime
Authors:Jan C A Boeyens  Leanne M Cook  Tak-ho Ngoi  David H Reid
Institution:(1) Center for Molecular Design, Department of Chemistry, University of the Witwatersrand, P.O. Wits, 2050 Johannesburg, South Africa
Abstract:The crystal structure of two isomeric oximes, C11N10N2OS have been studied by X-ray diffraction. The open-chain thiocyanato derivative is somewhat'less dense and crystallizes with the orthorhombic space group Pbcn;a,b,c=18.718(1), 10.601(3), 11.528(1) Å,Z=8. The heterocyclic isomer occurs as pseudo-orthorhombic (Cmma)twinned crystals of space group P21/n, a, b, c, beta=12.11(1), 7.46(1), 12.12(1) Å, 100.09(1)o,Z=4. Twinning occurs as a result of the near-equality of the monoclinica andc cell constants.
Keywords:Isomeric oximes  X-ray diffraction  heterocyclic isomer
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