Crystallography Open Database

Information card for entry 4322256

Preview

Coordinates	4322256.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C112 H232 Cl8 N32 Ni8 O44 S8
Calculated formula	C28 H58 Cl2 N8 Ni2 O11 S2
Title of publication	Coordination and Conversion of Urea at Dinuclear μ-Acetato Nickel(II) Complexes with Symmetric and Asymmetric Cores
Authors of publication	Matthias Konrad; Franc Meyer; Albrecht Jacobi; Peter Kircher; Peter Rutsch; Laszlo Zsolnai
Journal of publication	Inorganic Chemistry
Year of publication	1999
Journal volume	38
Pages of publication	4559 - 4566
a	13.932 ± 0.003 Å
b	18.748 ± 0.004 Å
c	15.517 ± 0.003 Å
α	90°
β	91.07 ± 0.03°
γ	90°
Cell volume	4052.3 ± 1.5 Å³
Cell temperature	200 K
Ambient diffraction temperature	200 K
Number of distinct elements	7
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	0.1792
Residual factor for significantly intense reflections	0.0582
Weighted residual factors for significantly intense reflections	0.1295
Weighted residual factors for all reflections included in the refinement	0.162
Goodness-of-fit parameter for all reflections included in the refinement	0.854
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
179325 (current)	2016-03-23	cif/4/32/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/32/22.	4322256.cif
120105	2014-07-12	Adding DOIs to range 4/32 structures.	4322256.cif
34330	2012-02-24	cif/4/ Reorganising CIF range 4 into a prefix tree.	4322256.cif
20527	2011-06-11	../uploads/cif-deposit/cod/cif Adding structures of 4322256 via cif-deposit CGI script.	4322256.cif