Hieu Truong Hong, Anh Le Tuan, Soldatenkov Anatoly T, Tuyen Nguyen Van, Khrustalev Victor N
Institute of Chemistry, Vietnam Academy of Science and Technology, 18 Hoang Quoc Viet, Hanoi, Vietnam.
Department of Chemistry, Vietnam National University, 144 Xuan Thuy, Cau Giay, Hanoi, Vietnam.
Acta Crystallogr E Crystallogr Commun. 2016 May 20;72(Pt 6):829-32. doi: 10.1107/S2056989016007556. eCollection 2016 Jun 1.
The title compound, C26H32N2O4(M)·C2H4O2, (I), is the product of the Petrenko-Kritchenko condensation of N-propyl-piperidinone with 1,5-bis-(2-formyl-phen-oxy)-3-oxa-pentane and ammonium acetate. In M, the aza-14-crown-3-ether ring adopts a bowl conformation, with the configuration of the C-O-C-C -O-C-C-O-C polyether chain being t-g ((-))-t-t-g ((+))-t (t = trans, 180°; g = gauche, ±60°). The dihedral angle between the planes of the benzene rings fused to the aza-14-crown-4-ether moiety is 62.75 (5)°. The central piperidinone ring has a boat conformation, whereas the terminal piperidinone ring adopts a chair conformation. The boat conformation of the central piperidinone ring is supported by the bifurcated intra-molecular N-H⋯O hydrogen bond. In the crystal, each solvent mol-ecule is linked to mol-ecule M via strong O-H⋯N hydrogen bonding, forming hydrogen-bonded pairs of mol-ecules, which further inter-act through weak C-H⋯O hydrogen bonds, forming layers parallel to the ac plane.
标题化合物C26H32N2O4(M)·C2H4O2,(I),是N-丙基哌啶酮与1,5-双-(2-甲酰基苯氧基)-3-氧杂戊烷和醋酸铵发生彼得连科-克里琴科缩合反应的产物。在M中,氮杂-14-冠-3-醚环呈碗状构象,C-O-C-C -O-C-C-O-C聚醚链的构型为t-g ((-))-t-t-g ((+))-t(t = 反式,180°;g = 顺式,±60°)。与氮杂-14-冠-4-醚部分稠合的苯环平面之间的二面角为62.75 (5)°。中心哌啶酮环呈船式构象,而末端哌啶酮环呈椅式构象。中心哌啶酮环的船式构象由分叉的分子内N-H⋯O氢键支撑。在晶体中,每个溶剂分子通过强O-H⋯N氢键与分子M相连,形成氢键结合的分子对,这些分子对进一步通过弱C-H⋯O氢键相互作用,形成平行于ac平面的层。