Crystallography Open Database

Information card for entry 4502359

Preview

Coordinates	4502359.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C45 H30 N12 O4 S6 Zn4
Calculated formula	C45 H30 N12 O4 S6 Zn4
Title of publication	A Series of Polynuclear Complexes of d10Metals With Interesting Luminescent Properties
Authors of publication	Chen, Shan-Ci; Yu, Rong-Min; Zhao, Zhen-Guo; Chen, Shu-Mei; Zhang, Qi-Sheng; Wu, Xiao-Yuan; Wang, Fei; Lu, Can-Zhong
Journal of publication	Crystal Growth & Design
Year of publication	2010
Journal volume	10
Journal issue	3
Pages of publication	1155
a	22.3402 ± 0.0017 Å
b	10.4269 ± 0.0004 Å
c	25.0451 ± 0.0017 Å
α	90°
β	118.069 ± 0.005°
γ	90°
Cell volume	5147.8 ± 0.6 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	6
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	0.0727
Residual factor for significantly intense reflections	0.0573
Weighted residual factors for significantly intense reflections	0.155
Weighted residual factors for all reflections included in the refinement	0.1724
Goodness-of-fit parameter for all reflections included in the refinement	1.162
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
179554 (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 4/50/23.	4502359.cif
91935	2013-12-29	cod/ (saulius@koala.ibt.lt) Adding DOIs that could be assigned unambiguously to the rest of COD CIFs.	4502359.cif
36369	2012-03-01	../uploads/cif-deposit/cod/cif Adding structures of 4502359 via cif-deposit CGI script.	4502359.cif