Crystallography Open Database

Information card for entry 8107700

Preview

Coordinates	8107700.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C30 H40 N2 Ni O2
Calculated formula	C30 H40 N2 Ni O2
Title of publication	Crystal structure of dicarbonyl[N,N′-(1,2-dimethyl-1,2-ethanediylidene)bis[2,6-bis(1-methylethyl)benzenamine]-N,N′]nickel(0), C30H40N2NiO2
Authors of publication	Shen, Lingyi; Xu, Na; Jiang, Mengna; Zhao, Jiang; Xu, Xiaoling; Yang, Xian-Jiong; Zhang, Qi-Long
Journal of publication	Zeitschrift für Kristallographie - New Crystal Structures
Year of publication	2023
Journal volume	238
Journal issue	6
Pages of publication	1195 - 1197
a	12.8114 ± 0.0019 Å
b	21.301 ± 0.003 Å
c	10.6536 ± 0.0016 Å
α	90°
β	90°
γ	90°
Cell volume	2907.3 ± 0.7 Å³
Cell temperature	273 ± 2 K
Ambient diffraction temperature	273 ± 2 K
Number of distinct elements	5
Space group number	62
Hermann-Mauguin space group symbol	P n m a
Hall space group symbol	-P 2ac 2n
Residual factor for all reflections	0.0333
Residual factor for significantly intense reflections	0.029
Weighted residual factors for significantly intense reflections	0.0773
Weighted residual factors for all reflections included in the refinement	0.0808
Goodness-of-fit parameter for all reflections included in the refinement	1.06
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
287961 (current)	2023-12-04	cif/ Adding structures of 8107700 via cif-deposit CGI script.	8107700.cif