双-4-杂氮-四环[5.3.02,6.08,10]十二-11-烯-3,5-二酮化合物的晶体结构。

IF 0.5 Q4 CRYSTALLOGRAPHY

Acta Crystallographica Section E: Crystallographic Communications Pub Date : 2025-05-01 DOI:10.1107/S2056989025003500

Christina Yu Jiang , Richard J. Staples , Shannon M. Biros

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引用次数: 0

摘要

分子的4 - ({3 - [(3 5-dioxo-4-aza-tetra-cyclo - [5.3.2.02 6.08 10] dodec-11-en-4-yl) meth] phen-yl} meth) 4-aza-tetra-cyclo——[5.3.2.02 6.08 10]dodec-11-ene-3 5-dione, C30H28N2O4,其中包含两个替换(2.2.2)bi-cyclo-octene m-xylenedi-amine环,环系统通过链接bi-cyclo-octene环的环系统采用近乎完美的船从Cremer-Pople分析所确定的构象。这两种环系统被融合成一个五元亚胺环，其取向的桥头堡环丙基环。晶体结构的特点是C=O⋯π相互作用以及C- h⋯O氢键。

本文章由计算机程序翻译，如有差异，请以英文原文为准。

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Crystal structure of a bis-4-azatetracyclo[5.3.2.02,6.08,10]dodec-11-ene-3,5-dione compound

The crystal structure of the title compound features C=O⋯π interactions along with C—H⋯O hydrogen bonds.

In the molecule of 4-({3-[(3,5-dioxo-4-azatetracyclo[5.3.2.0^2,6.0^8,10]dodec-11-en-4-yl)methyl]phenyl}methyl)-4-azatetracyclo[5.3.2.0^2,6.0^8,10]dodec-11-ene-3,5-dione, C₃₀H₂₈N₂O₄, which contains two substituted [2.2.2]bicyclooctene ring systems linked through a m-xylenediamine ring, the six-membered rings of the bicyclooctene ring systems adopt nearly perfect boat conformations as determined from Cremer–Pople analysis. Both ring systems are fused to a five-membered imide ring that is oriented endo to a bridgehead cyclopropyl ring. The crystal structure features C=O⋯π interactions along with C—H⋯O hydrogen bonds.

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来源期刊

Acta Crystallographica Section E: Crystallographic Communications Chemistry-Chemistry (all)

CiteScore

1.90

自引率

0.00%

发文量

351

审稿时长

3 weeks

期刊介绍： Acta Crystallographica Section E: Crystallographic Communications is the IUCr''s open-access structural communications journal. It provides a fast, simple and easily accessible publication mechanism for crystal structure determinations of inorganic, metal-organic and organic compounds. The electronic submission, validation, refereeing and publication facilities of the journal ensure rapid and high-quality publication of fully validated structures. The primary article category is Research Communications; these are peer-reviewed articles describing one or more structure determinations with appropriate discussion of the science.