Crystallography Open Database

Information card for entry 4348388

Preview

Coordinates	4348388.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C42 H32 N6 Ni O11
Calculated formula	C42 H30 N6 Ni O11
Title of publication	Assembly, structures, photophysical properties and photocatalytic activities of a series of coordination polymers constructed from semi-rigid bis-pyridyl-bis-amide and benzenetricarboxylic acid
Authors of publication	Wang, Xiuli; Le, Mao; Lin, Hong-Yan; Luan, Jian; Liu, Guo-Cheng; Sui, Fang-Fang; Chang, Zhi-Han
Journal of publication	Inorganic Chemistry Frontiers
Year of publication	2015
Journal volume	2
Journal issue	4
Pages of publication	373
a	9.4576 ± 0.0004 Å
b	11.757 ± 0.0006 Å
c	17.2174 ± 0.0008 Å
α	83.194 ± 0.001°
β	80.712 ± 0.001°
γ	77.628 ± 0.001°
Cell volume	1838.47 ± 0.15 Å³
Cell temperature	296 ± 2 K
Ambient diffraction temperature	296 ± 2 K
Number of distinct elements	5
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0526
Residual factor for significantly intense reflections	0.0451
Weighted residual factors for significantly intense reflections	0.1091
Weighted residual factors for all reflections included in the refinement	0.1128
Goodness-of-fit parameter for all reflections included in the refinement	1.041
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
232897 (current)	2019-11-23	cif/ Adding structures of 4348387, 4348388, 4348389, 4348390, 4348391, 4348392, 4348393, 4348394, 4348395, 4348396 via cif-deposit CGI script.	4348388.cif