首页> 外文期刊>Journal of Molecular Biochemistry >Crystal structural studies of ethyl-5-(4-chlorophenylsulfonyl)-4-hydroxy-2, 6-dip-tolyl-1, 2, 5, 6-tetrahydropyridine-3-carboxylate and diethyl 4-hydroxy-2-(4-nitrophenyl)-5-(phenylsulfonyl)-6-(phenylsulfonylmethyl)cyclohexa-3,6-diene-1,3-dicarboxylate
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Crystal structural studies of ethyl-5-(4-chlorophenylsulfonyl)-4-hydroxy-2, 6-dip-tolyl-1, 2, 5, 6-tetrahydropyridine-3-carboxylate and diethyl 4-hydroxy-2-(4-nitrophenyl)-5-(phenylsulfonyl)-6-(phenylsulfonylmethyl)cyclohexa-3,6-diene-1,3-dicarboxylate

机译:5-(4-氯苯基磺酰基)-4-羟基-2、6-二甲苯基-1、2、5、6-四氢吡啶-3-羧酸酯和4-乙基-2-羟基-2-(4-的乙基)的晶体结构研究硝基苯基)-5-(苯磺酰基)-6-(苯磺酰基甲基)环己-3,6-二烯-1,3-二羧酸酯

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The crystal structures of trans,trans-Ethyl-5-(4-chlorophenylsulfonyl)-4-hydroxy-2,6-dip-tolyl-1,2,5,6-tetrahydropyridine-3-carboxylate (Ia) and cis-Diethyl 4-hydroxy-2-(4-nitrophenyl)-5-(phenylsulfonyl)-6-(phenylsulfonylmethyl)cyclohexa-3,6-diene-1,3-dicarboxylate (Ib) were elucidated by single crystal X ray diffraction. Compound (Ia) C28H28Cl NO5S, crystallizes in the monoclinic system, space group P 21/c, with a = 9.4530(7) ?, b = 25.366(2) ?, c = 11.4353(8) ?, β = 103.092(7)°, V = 2670 (3) ?3 and Z = 4. The compound (Ib), C31H29N1O11S2, crystallizes in the monoclinic system, space group P 21/c, with a = 21.179(4) ?, b = 8.4998(16) ?, c = 17.347(3) ?, β = 102.563(3)°, V = 3048.0(10) ?3 and Z = 4. The central piperidine ring of compound (Ia) adopts the sofa conformation and the central cyclohexadiene ring of compound (Ib) adopts the boat conformation. Details of the compounds preparation, crystal structures and hydrogen bonding interactions of the compounds are discussed.
机译:反式,反式乙基-5-(4-氯苯基磺酰基)-4-羟基-2,6-二甲苯基-1,2,5,6-四氢吡啶-3-羧酸酯(Ia)和顺式二乙基的晶体结构通过单晶X射线衍射阐明了4-羟基-2-(4-硝基苯基)-5-(苯磺酰基)-6-(苯磺酰基甲基)环己-3,6-二烯-1,3-二羧酸酯(Ib)。化合物(Ia)C28H28Cl NO5S在单斜晶系空间群P 21 / c中结晶,a = 9.4530(7)α,b = 25.366(2)α,c = 11.4353(8)α,β= 103.092(7 )°,V = 2670(3)α3,Z = 4.化合物(Ib)C31H29N1O11S2在单斜晶系空间群P 21 / c中结晶,a = 21.179(4)α,b = 8.4998( 16)α,c = 17.347(3)α,β= 102.563(3)°,V = 3048.0(10)α3,Z = 4。化合物(Ia)的中央哌啶环采用沙发构象,并且中央环己二烯化合物(Ib)的环采用船形。讨论了化合物的制备,化合物的晶体结构和氢键相互作用的细节。

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