Crystallography Open Database

Information card for entry 7005236

Preview

Coordinates	7005236.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C48 H48 N20 Ni4 O10
Calculated formula	C48 H40 N20 Ni4 O10
Title of publication	Metal complexes formed by metal-assisted solvolysis of di-pyridylketone azine: structures and magnetic properties.
Authors of publication	Wu, Da-Yu; Huang, Wei; Hua, Wei-Jie; Song, You; Duan, Chun-Ying; Li, Shu-Hua; Meng, Qing-Jin
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2007
Journal issue	18
Pages of publication	1838 - 1845
a	13.4319 ± 0.001 Å
b	10.9629 ± 0.0008 Å
c	20.163 ± 0.0014 Å
α	90°
β	90.586 ± 0.001°
γ	90°
Cell volume	2968.9 ± 0.4 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	5
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/c 1
Hall space group symbol	-P 2ybc
Residual factor for all reflections	0.0746
Residual factor for significantly intense reflections	0.0537
Weighted residual factors for significantly intense reflections	0.1715
Weighted residual factors for all reflections included in the refinement	0.1857
Goodness-of-fit parameter for all reflections included in the refinement	1.046
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/7005236.html