Crystallography Open Database

Information card for entry 4503153

Preview

Coordinates	4503153.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C44 H40 Ag2 Cl2 N4 O6 S4
Calculated formula	C44 H40 Ag2 Cl2 N4 O6 S4
Title of publication	Formation of Disilver(I) Metallacycle and One-Dimensional Polymeric Chain from the Same Mononuclear Building Block: Assembly Mechanism upon Crystallization
Authors of publication	Chen, Chun-Long; Yu, Zhi-Quan; Zhang, Qian; Pan, Mei; Zhang, Jian-Yong; Zhao, Cun-Yuan; Su, Cheng-Yong
Journal of publication	Crystal Growth & Design
Year of publication	2008
Journal volume	8
Journal issue	3
Pages of publication	897
a	15.101 ± 0.004 Å
b	8.02 ± 0.002 Å
c	36.983 ± 0.01 Å
α	90°
β	90°
γ	90°
Cell volume	4479 ± 2 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	7
Space group number	60
Hermann-Mauguin space group symbol	P b c n
Hall space group symbol	-P 2n 2ab
Residual factor for all reflections	0.1552
Residual factor for significantly intense reflections	0.1235
Weighted residual factors for significantly intense reflections	0.2227
Weighted residual factors for all reflections included in the refinement	0.2392
Goodness-of-fit parameter for all reflections included in the refinement	1.097
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
179562 (current)	2016-03-24	cif/4/50/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/50/31.	4503153.cif
120110	2014-07-12	Adding DOIs to range 4/50 structures.	4503153.cif
41386	2012-03-13	../uploads/cif-deposit/cod/cif Adding structures of 4503151, 4503152, 4503153, 4503154, 4503155 via cif-deposit CGI script.	4503153.cif