Crystallography Open Database

Information card for entry 8102496

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Coordinates	8102496.cif

Structure parameters

Chemical name	(1,8-dimethyl-1,3,6,8,10,13-hexaazacyclotetradecane)nickel(II) diperchlorate
Formula	C10 H26 Cl2 N6 Ni O8
Calculated formula	C10 H26 Cl2 N6 Ni O8
Title of publication	Crystal structure of (1,8-dimethyl-1,3,6,8,10,13-hexaazacyclotetradecane)nickel(II) diperchlorate, [Ni(C10H26N6)][ClO4]2
Authors of publication	Zhaowei Yan; Taohai Li
Journal of publication	Zeitschrift für Kristallographie - New Crystal Structures
Year of publication	2009
Journal volume	224
Journal issue	3
Pages of publication	505
a	8.536 ± 0.005 Å
b	8.73 ± 0.005 Å
c	12.736 ± 0.007 Å
α	90°
β	102.45 ± 0.011°
γ	90°
Cell volume	926.8 ± 0.9 Å³
Cell temperature	173 ± 2 K
Ambient diffraction temperature	173 ± 2 K
Number of distinct elements	6
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/n 1
Hall space group symbol	-P 2yn
Residual factor for all reflections	0.0523
Residual factor for significantly intense reflections	0.049
Weighted residual factors for significantly intense reflections	0.1378
Weighted residual factors for all reflections included in the refinement	0.1416
Goodness-of-fit parameter for all reflections included in the refinement	1.06
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
176432 (current)	2016-02-14	cif/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries.	8102496.cif
35911	2012-02-28	cif/ Reorganising ranges 1, 3, 5, 6 and 8 into a prefix-directory tree.	8102496.cif
13235	2011-03-06	../uploads/cif-deposit/cod/cif Adding structures of 8102496 via cif-deposit CGI script.	8102496.cif