Crystallography Open Database

Information card for entry 7021429

Preview

Coordinates	7021429.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C13 H17 N2 Ni O11
Calculated formula	C13 H17 N2 Ni O11
Title of publication	Co(ii) and Ni(ii) complexes based on anthraquinone-1,4,5,8-tetracarboxylic acid (H4AQTC): canted antiferromagnetism and slow magnetization relaxation in {[Co2(AQTC)(H2O)6]·6H2O}.
Authors of publication	Yan, Wei-Hong; Bao, Song-Song; Huang, Jian; Ren, Min; Sheng, Xiao-Li; Cai, Zhong-Sheng; Lu, Chang-Sheng; Meng, Qing-Jin; Zheng, Li-Min
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2013
Journal volume	42
Journal issue	23
Pages of publication	8241 - 8248
a	8.743 ± 0.0006 Å
b	11.899 ± 0.0008 Å
c	16.6418 ± 0.0011 Å
α	90°
β	101.83 ± 0.001°
γ	90°
Cell volume	1694.5 ± 0.2 Å³
Cell temperature	296 ± 2 K
Ambient diffraction temperature	296 ± 2 K
Number of distinct elements	5
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	0.0374
Residual factor for significantly intense reflections	0.0278
Weighted residual factors for significantly intense reflections	0.0645
Weighted residual factors for all reflections included in the refinement	0.0691
Goodness-of-fit parameter for all reflections included in the refinement	1
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
179919 (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 7/02/14.	7021429.cif
86937	2013-07-12	cif/ Adding structures of 7021428, 7021429, 7021430 via cif-deposit CGI script.	7021429.cif