Crystallography Open Database

Information card for entry 4308824

Preview

Coordinates	4308824.cif
Original paper (by DOI)	HTML

Structure parameters

Common name	Tetrapentylammonium nickel(II) dicyanamide
Chemical name	Tetrapentylammonium nickel(II) dicyanamide
Formula	C26 H44 N10 Ni
Calculated formula	C26 H44 N9.998 Ni
Title of publication	Structural and Magnetic Diversity in Tetraalkylammonium Salts of Anionic M[N(CN)2]3- (M= Mn and Ni) Three-Dimensional Coordination Polymers
Authors of publication	John A. Schlueter; Jamie L. Manson; Urs Geiser
Journal of publication	Inorganic Chemistry
Year of publication	2005
Journal volume	44
Pages of publication	3194 - 3202
a	12.938 ± 0.0004 Å
b	11.6233 ± 0.0004 Å
c	19.8038 ± 0.0007 Å
α	90°
β	90°
γ	90°
Cell volume	2978.14 ± 0.17 Å³
Cell temperature	298 ± 2 K
Ambient diffraction temperature	298 ± 2 K
Number of distinct elements	4
Space group number	52
Hermann-Mauguin space group symbol	P n n a
Hall space group symbol	-P 2a 2bc
Residual factor for all reflections	0.065
Residual factor for significantly intense reflections	0.0452
Weighted residual factors for significantly intense reflections	0.1165
Weighted residual factors for all reflections included in the refinement	0.1304
Goodness-of-fit parameter for all reflections included in the refinement	1.045
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
179126 (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 4/30/88.	4308824.cif
120081	2014-07-12	Adding DOIs to range 4/30 structures.	4308824.cif
34330	2012-02-24	cif/4/ Reorganising CIF range 4 into a prefix tree.	4308824.cif
1526	2010-09-26	cif/4/ Adding new CIFs from Inorg. Chem. 2005 deposited via Web deposition site to the COD test database (and transferede to the main COD database after renaming).	4308824.cif