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5''-(4-甲氧基-亚苄基)-7'-(4-甲氧基-苯基)-1''-甲基-5',6',7',7a'-四氢-二螺-[苊烯-1,5'-吡咯并-[1,2-c][1,3]噻唑-6',3''-哌啶]-2,4''-二酮

5''-(4-Meth-oxy-benzyl-idene)-7'-(4-meth-oxy-phen-yl)-1''-methyl-5',6',7',7a'-tetra-hydro-dispiro-[acenaphthene-1,5'-pyrrolo-[1,2-c][1,3]thia-zole-6',3''-piperidine]-2,4''-dione.

作者信息

Suresh J, Vishnupriya R, Kumar R Ranjith, Sivakumar S, Lakshman P L Nilantha

出版信息

Acta Crystallogr Sect E Struct Rep Online. 2011 Dec 1;67(Pt 12):o3210. doi: 10.1107/S1600536811045934. Epub 2011 Nov 5.

DOI:10.1107/S1600536811045934
PMID:22199728
原文链接:https://pmc.ncbi.nlm.nih.gov/articles/PMC3238875/
Abstract

In the title compound, C(37)H(34)N(2)O(4)S, the piperidine ring adopts a half-chair conformation. The thia-zole ring adopts a slightly twisted envelope conformation and the pyrrole ring adopts an envelope conformation; in each case, the C atom linking the rings is the flap atom. An intra-molecular C-H⋯O inter-action is noted. The crystal structure is stabilized by C-H⋯O and C-H⋯π inter-actions.

摘要

在标题化合物C(37)H(34)N(2)O(4)S中，哌啶环呈半椅式构象。噻唑环呈轻微扭曲的信封式构象，吡咯环呈信封式构象；在每种情况下，连接环的C原子为折叶原子。注意到分子内存在C-H⋯O相互作用。晶体结构通过C-H⋯O和C-H⋯π相互作用得以稳定。

https://cdn.ncbi.nlm.nih.gov/pmc/blobs/3650/3238875/e21fb46cd1a0/e-67-o3210-fig2.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/3650/3238875/5decddf46565/e-67-o3210-fig1.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/3650/3238875/e21fb46cd1a0/e-67-o3210-fig2.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/3650/3238875/5decddf46565/e-67-o3210-fig1.jpg
https://cdn.ncbi.nlm.nih.gov/pmc/blobs/3650/3238875/e21fb46cd1a0/e-67-o3210-fig2.jpg

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