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首页> 外文期刊>Journal of chemical crystallography >Synthesis and crystal structures of 2-amino-3-cyano-4(2-chlorophenyl)-1,4-dihydro-2H-pyrano[3, 2-h] quinoline and 2-amino-3-cyano-4-(2-chlorophenyl)-8(2-chlorobenzylidene)-1,4,5,6,7,8-hexa hydrobenzo[b]pyran
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Synthesis and crystal structures of 2-amino-3-cyano-4(2-chlorophenyl)-1,4-dihydro-2H-pyrano[3, 2-h] quinoline and 2-amino-3-cyano-4-(2-chlorophenyl)-8(2-chlorobenzylidene)-1,4,5,6,7,8-hexa hydrobenzo[b]pyran

机译:2-氨基-3-氰基-4(2-氯苯基)-1,4-二氢-2H-吡喃并[3,2-h]喹啉和2-氨基-3-氰基-4-(2)的合成及晶体结构-氯苯基)-8(2-氯亚苄基)-1,4,5,6,7,8-六氢苯并[b]吡喃

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摘要

The title compounds 2-amino-3-cyano-4-(2-chlorophenyl)-1,4-dihydro-2H-pyrano[3, 2-h]quinoline 1 (C19H12ClN3O, M-r = 333.77) and 2-amino-3-cyano-4-(2-chlorophenyl)-8-(2-chlorobenzylidene)-1,4,5,6,7,8-hex ahydrobenzo[b]pyran 2 were synthesized and crystallized. The crystals of compound 1 are triclinic, space group P-1, a = 7.488( 2), b = 9.127(3), c = 12.252(3) Angstrom, alpha = 73.58(2), beta = 78.38(2)degrees, gamma = 75.39(2), Z = 2, V = 769.5(4) Angstrom(3); The compound 2 crystallizes in space group P2(1), with cell parameters a = 13.582(2), b = 8.974(1), c = 16.960(2) Angstrom, beta = 103.34(1)degrees and D-calc = 1.352 g/cm(-3) for Z = 4. X-ray analysis reveals that atoms C(1)-C(5) and O form a pyran ring in compound 1, which adopts half-chair conformation. In compound 2 the atoms C( 2)-C(16) and O form a pyran ring which adopts boat conformation, another six-membered ring (C(8)-C(13)) adopts a half-chair conformation. In addition, there are intermolecular hydrogen bonds in the crystal structures 1 and 2. [References: 17]
机译:标题化合物2-氨基-3-氰基-4-(2-氯苯基)-1,4-二氢-2H-吡喃并[3,2-h]喹啉1(C19H12ClN3O,Mr = 333.77)和2-amino-3合成并结晶了-氰基-4-(2-氯苯基)-8-(2-氯亚苄基)-1,4,5,6,7,8-六氢脱水苯并[b]吡喃2。化合物1的晶体为三斜晶系,空间群为P-1,a = 7.488(2),b = 9.127(3),c = 12.252(3)埃,α= 73.58(2),β= 78.38(2)度,γ= 75.39(2),Z = 2,V = 769.5(4)埃(3);化合物2在空间群P2(1)/ n中结晶,单元参数为a = 13.582(2),b = 8.974(1),c = 16.960(2)埃,β= 103.34(1)度和D-calc对于Z = 4,= 1.352g / cm(-3)。X射线分析表明,原子C(1)-C(5)和O在化合物1中形成吡喃环,该吡喃环采用半椅构型。在化合物2中,原子C(2)-C(16)和O形成一个吡喃环,该环采用船形,另一个六元环(C(8)-C(13))采用半椅形。另外,在晶体结构1和2中存在分子间氢键。[参考文献:17]

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