Crystallography Open Database

Information card for entry 7220760

7220759 << 7220760 >> 7220761

Preview

Coordinates	7220760.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C25 H33 Cl Cu2 N6 O10
Calculated formula	C25 H33 Cl Cu2 N6 O10
Title of publication	Synthesis and structure of new dicopper(ii) complexes bridged by asymmetric N,N′-bis(substituted)oxamides: in vitro anticancer activity and molecular docking studies based on bio-macromolecular interaction
Authors of publication	Zheng, Kang; Jiang, Liu; Li, Yan-Tuan; Wu, Zhi-Yong; Yan, Cui-Wei
Journal of publication	RSC Adv.
Year of publication	2015
Journal volume	5
Journal issue	64
Pages of publication	51730
a	7.9614 ± 0.0008 Å
b	23.877 ± 0.002 Å
c	8.4244 ± 0.0008 Å
α	90°
β	109.146 ± 0.003°
γ	90°
Cell volume	1512.8 ± 0.2 Å³
Cell temperature	296 ± 2 K
Ambient diffraction temperature	296 ± 2 K
Number of distinct elements	6
Space group number	4
Hermann-Mauguin space group symbol	P 1 21 1
Hall space group symbol	P 2yb
Residual factor for all reflections	0.0744
Residual factor for significantly intense reflections	0.0669
Weighted residual factors for significantly intense reflections	0.1913
Weighted residual factors for all reflections included in the refinement	0.1964
Goodness-of-fit parameter for all reflections included in the refinement	1.062
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
176428 (current)	2016-02-13	Replaced deprecated COD CIF data names with their more modern alternatives. The _cod_cif_authors_sg_Hall and _cod_cif_authors_sg_H-M data items were renamed to _cod_original_sg_symbol_Hall and _cod_cif_authors_sg_H-M respectively.	7220760.cif
139125	2015-06-12	cif/ Adding structures of 7220760, 7220761 via cif-deposit CGI script.	7220760.cif