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(3aR,6S,7aR)-7a-溴-2-[(4-甲基苯基)磺酰基]-1,2,3,6,7,7a-六氢-3a,6-环氧异吲哚

(3aR,6S,7aR)-7a-Bromo-2-[(4-methyl-phen-yl)sulfon-yl]-1,2,3,6,7,7a-hexa-hydro-3a,6-ep-oxy-isoindole.

作者信息

Koşar Başak, Demircan Aydın, Arslan Hakan, Büyükgüngör Orhan

出版信息

Acta Crystallogr Sect E Struct Rep Online. 2011 Apr 1;67(Pt 4):o994-5. doi: 10.1107/S1600536811010750. Epub 2011 Mar 31.

Abstract

In the title compound, C(15)H(16)BrNO(3)S, the boat form of the six-membered ring is almost symmetrical with respect to the ep-oxy bridge. The two five-membered rings generated by the ep-oxy bridge of the six-membered ring adopt envelope conformations, whereas the N-containing five-membered ring adopts a twisted conformation. In the crystal, mol-ecules are linked by C-H⋯O hydrogen bonds.

摘要

在标题化合物C₁₅H₁₆BrNO₃S中,六元环的船式构象相对于环氧桥几乎是对称的。由六元环的环氧桥生成的两个五元环呈信封式构象,而含氮五元环呈扭曲构象。在晶体中,分子通过C—H⋯O氢键相连。

https://cdn.ncbi.nlm.nih.gov/pmc/blobs/fa26/3099917/ed08c8344f1e/e-67-0o994-fig1.jpg

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