Crystallography Open Database

Information card for entry 4503154

Preview

Coordinates	4503154.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C44 H40 Ag2 Cl2 N4 O8 S4
Calculated formula	C44 H40 Ag2 Cl2 N4 O8 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	15.722 ± 0.007 Å
b	13.768 ± 0.006 Å
c	20.967 ± 0.01 Å
α	90°
β	99.739 ± 0.009°
γ	90°
Cell volume	4473 ± 4 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	7
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/c 1
Hall space group symbol	-P 2ybc
Residual factor for all reflections	0.1268
Residual factor for significantly intense reflections	0.0651
Weighted residual factors for significantly intense reflections	0.1715
Weighted residual factors for all reflections included in the refinement	0.216
Goodness-of-fit parameter for all reflections included in the refinement	1.038
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
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.	4503154.cif
120110	2014-07-12	Adding DOIs to range 4/50 structures.	4503154.cif
41386	2012-03-13	../uploads/cif-deposit/cod/cif Adding structures of 4503151, 4503152, 4503153, 4503154, 4503155 via cif-deposit CGI script.	4503154.cif