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Acta Crystallogr Sect E Struct Rep Online. 2012 Mar 1;68(Pt 3):o814. doi: 10.1107/S1600536812007131. Epub 2012 Feb 24.
2
(2E)-2-(4-Bromo-benzyl-idene)-2,3-di-hydro-1H-inden-1-one.(2E)-2-(4-溴-亚苄基)-2,3-二氢-1H-茚-1-酮
Acta Crystallogr Sect E Struct Rep Online. 2012 Mar 1;68(Pt 3):o755. doi: 10.1107/S1600536812006654. Epub 2012 Feb 17.
3
Structure validation in chemical crystallography.化学晶体学中的结构验证
Acta Crystallogr D Biol Crystallogr. 2009 Feb;65(Pt 2):148-55. doi: 10.1107/S090744490804362X. Epub 2009 Jan 20.
4
Synthesis, antichagasic in vitro evaluation, cytotoxicity assays, molecular modeling and SAR/QSAR studies of a 2-phenyl-3-(1-phenyl-1H-pyrazol-4-yl)-acrylic acid benzylidene-carbohydrazide series.
Bioorg Med Chem. 2009 Jan 1;17(1):295-302. doi: 10.1016/j.bmc.2008.10.085. Epub 2008 Nov 5.
5
A short history of SHELX.SHELX简史。
Acta Crystallogr A. 2008 Jan;64(Pt 1):112-22. doi: 10.1107/S0108767307043930. Epub 2007 Dec 21.

(2E)-2-(Furan-2-yl-methyl-idene)-2,3-dihydro-1H-inden-1-one.

作者信息

Asiri Abdullah M, Faidallah Hassan M, Al-Nemari Khulud F, Ng Seik Weng, Tiekink Edward R T

出版信息

Acta Crystallogr Sect E Struct Rep Online. 2012 Apr 1;68(Pt 4):o1065. doi: 10.1107/S1600536812010501. Epub 2012 Mar 14.

DOI:10.1107/S1600536812010501
PMID:22589932
原文链接:https://pmc.ncbi.nlm.nih.gov/articles/PMC3344023/
Abstract

In the title compound, C(14)H(10)O(2), the five-membered ring of the inden-1-one residue is almost planar (r.m.s. deviation = 0.035 Å). A twist about the single bond linking the two residues is evident [C-C-C-C torsion angle = -13.2 (5)°]. The three-dimensional architecture is stabilized by C-H⋯O (involving the trifurcated carbonyl O atom), C-H⋯π and π-π inter-actions [between the five- and six-membered rings of inden-1-one residues; ring centroid-centroid distance = 3.7983 (17) Å]. The sample studied was a non-merohedral twin; the minor component refined to approximately 36%.

摘要