Crystallography Open Database

Information card for entry 2022534

2022533 << 2022534 >> 2022535

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Structure parameters

Chemical name	Chlorido(3,9-dimethylundeca-3,8-diene-2,10-dione 10-oxime 2-oximato-κ^4^<i>N</i>,<i>N</i>',<i>N</i>'',<i>N</i>''')nickel(II)
Formula	C11 H19 Cl N4 Ni O2
Calculated formula	C11 H19 Cl N4 Ni O2
Title of publication	Mirror-plane disorder in a nickel chloride Schiff base complex: a suitable case study for crystallographic instruction
Authors of publication	Chang, Hsuan; Chen, Wen-Ching; Shen, Jiun-Shian; Ong, Tiow-Gan; Wang, Vincent C.-C.; Yap, Glenn P. A.
Journal of publication	Acta Crystallographica Section C Structural Chemistry
Year of publication	2022
Journal volume	78
Journal issue	3
a	14.3402 ± 0.0014 Å
b	14.2577 ± 0.0012 Å
c	13.1777 ± 0.0013 Å
α	90°
β	90°
γ	90°
Cell volume	2694.3 ± 0.4 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 2 K
Number of distinct elements	6
Space group number	64
Hermann-Mauguin space group symbol	C m c e
Hall space group symbol	-C 2ac 2
Residual factor for all reflections	0.0523
Residual factor for significantly intense reflections	0.0357
Weighted residual factors for significantly intense reflections	0.0713
Weighted residual factors for all reflections included in the refinement	0.0799
Goodness-of-fit parameter for all reflections included in the refinement	1.086
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	Yes

Version history

Revision	Date	Message	Files
272866 (current)	2022-02-09	cif/ hkl/ Adding structures of 2022534 via cif-deposit CGI script.	2022534.cif 2022534.hkl