Crystallography Open Database

Information card for entry 4307549

Preview

Coordinates	4307549.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C N2 Ni
Calculated formula	C N2 Ni
Title of publication	Synthesis, Crystal-Structure Determination and Magnetic Properties of Two New Transition-Metal Carbodiimides: CoNCN and NiNCN
Authors of publication	Manuel Krott; Xiaohui Liu; Boniface P. T. Fokwa; Manfred Speldrich; Heiko Lueken; Richard Dronskowski
Journal of publication	Inorganic Chemistry
Year of publication	2007
Journal volume	46
Pages of publication	2204 - 2207
a	3.1533 ± 0.0008 Å
b	3.1533 ± 0.0008 Å
c	9.272 ± 0.003 Å
α	90°
β	90°
γ	120°
Cell volume	79.84 ± 0.04 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	3
Space group number	194
Hermann-Mauguin space group symbol	P 63/m m c
Hall space group symbol	-P 6c 2c
Residual factor for all reflections	0.1397
Residual factor for significantly intense reflections	0.1045
Weighted residual factors for significantly intense reflections	0.1543
Weighted residual factors for all reflections included in the refinement	0.1638
Goodness-of-fit parameter for all reflections included in the refinement	1.441
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
179113 (current)	2016-03-23	cif/4/30/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/30/75.	4307549.cif
120081	2014-07-12	Adding DOIs to range 4/30 structures.	4307549.cif
34330	2012-02-24	cif/4/ Reorganising CIF range 4 into a prefix tree.	4307549.cif
1194	2010-06-06	cif/4/ Adding data from Inorg-Chem-2007_01-13/ processing directory.	4307549.cif