Crystallography Open Database

Information card for entry 7026613

Preview

Coordinates	7026613.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C72 H114 Cl6 N36 Ni12 O36
Calculated formula	C72 H66 Cl6 N36 Ni12 O36
Title of publication	Ferromagnetic coupling in oximato-bridged multi-decker Ni(II) clusters.
Authors of publication	Kou, Hui-Zhong; An, Guang-Yu; Ji, Cong-Min; Wang, Bing-Wu; Cui, Ai-Li
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2010
Journal volume	39
Journal issue	40
Pages of publication	9604 - 9610
a	13.743 ± 0.003 Å
b	14.563 ± 0.003 Å
c	14.993 ± 0.003 Å
α	75.69 ± 0.03°
β	72.86 ± 0.03°
γ	85.06 ± 0.03°
Cell volume	2778.2 ± 1.2 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	6
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.1033
Residual factor for significantly intense reflections	0.0826
Weighted residual factors for significantly intense reflections	0.212
Weighted residual factors for all reflections included in the refinement	0.2295
Goodness-of-fit parameter for all reflections included in the refinement	1.07
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
179972 (current)	2016-03-25	cif/7/02/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/02/66.	7026613.cif
93543	2014-01-13	cif/ Adding structures of 7026607, 7026608, 7026609, 7026610, 7026611, 7026612, 7026613 via cif-deposit CGI script.	7026613.cif