Crystallography Open Database

Information card for entry 7153916

Preview

Coordinates	7153916.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C39 H38 Cl2 N3 O6
Calculated formula	C39 H38 Cl2 N3 O6
Title of publication	Highly enantioselective synthesis of bisoxindoles with two vicinal quaternary stereocenters via Lewis base mediated addition of oxindoles to isatin-derived ketimines.
Authors of publication	Tang, Zhongkai; Shi, Yan; Mao, Haibin; Zhu, Xuebin; Li, Weipeng; Cheng, Yixiang; Zheng, Wen-Hua; Zhu, Chengjian
Journal of publication	Organic & biomolecular chemistry
Year of publication	2014
Journal volume	12
Journal issue	32
Pages of publication	6085 - 6088
a	10.14509 ± 0.00012 Å
b	9.34727 ± 0.00009 Å
c	19.6126 ± 0.0003 Å
α	90°
β	101.171 ± 0.0012°
γ	90°
Cell volume	1824.61 ± 0.04 Å³
Cell temperature	153 ± 2 K
Ambient diffraction temperature	153 ± 2 K
Number of distinct elements	5
Space group number	4
Hermann-Mauguin space group symbol	P 1 21 1
Hall space group symbol	P 2yb
Residual factor for all reflections	0.0707
Residual factor for significantly intense reflections	0.0694
Weighted residual factors for significantly intense reflections	0.1756
Weighted residual factors for all reflections included in the refinement	0.1772
Goodness-of-fit parameter for all reflections included in the refinement	1.02
Diffraction radiation wavelength	1.54184 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
180325 (current)	2016-03-26	cif/7/15/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/15/39.	7153916.cif
121770	2014-08-08	cif/ Updating files of 7153916 Original log message: Adding full bibliography for 7153916.cif.	7153916.cif
117872	2014-06-18	cif/ Adding structures of 7153916 via cif-deposit CGI script.	7153916.cif