Crystallography Open Database

Information card for entry 7232863

Preview

Coordinates	7232863.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C24 H16 N6 Ni O5 S
Calculated formula	C24 H16 N6 Ni O5 S
Title of publication	Syntheses, structures, and magnetic properties of mixed-ligand complexes based on 3,6-bis(benzimidazol-1-yl)pyridazine
Authors of publication	Dong, Jun-Liang; Zhu, Peng-Yin; Du, Jia-Qiang; Xie, Fei; Lan, Hai-Ming; Yang, Ru-Xia; Yang, Li-Zheng; Wang, Duo-Zhi
Journal of publication	RSC Advances
Year of publication	2019
Journal volume	9
Journal issue	31
Pages of publication	17560
a	13.039 ± 0.005 Å
b	18.606 ± 0.007 Å
c	10.943 ± 0.006 Å
α	90°
β	121.201 ± 0.006°
γ	90°
Cell volume	2270.8 ± 1.7 Å³
Cell temperature	170.15 K
Ambient diffraction temperature	170.15 K
Number of distinct elements	6
Space group number	9
Hermann-Mauguin space group symbol	C 1 c 1
Hall space group symbol	C -2yc
Residual factor for all reflections	0.0393
Residual factor for significantly intense reflections	0.0353
Weighted residual factors for significantly intense reflections	0.0963
Weighted residual factors for all reflections included in the refinement	0.0999
Goodness-of-fit parameter for all reflections included in the refinement	1.059
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
215708 (current)	2019-06-05	cif/ Adding structures of 7232863, 7232864, 7232865, 7232866, 7232867, 7232868 via cif-deposit CGI script.	7232863.cif