Crystallography Open Database

Information card for entry 4336662

Preview

Coordinates	4336662.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C79 H47 Cu3 F54 Gd N8 O22
Calculated formula	C79 H47 Cu3 F54 Gd N8 O22
Title of publication	Unprecedented Nitronyl Nitroxide Bridged 3d-4f Complexes: Structure and Magnetic Properties
Authors of publication	Mei Zhu; Yun-Gai Li; Yue Ma; Li-Cun Li; Dai-Zheng Liao
Journal of publication	Inorganic Chemistry
Year of publication	2013
Journal volume	52
Pages of publication	12326 - 12328
a	16.518 ± 0.007 Å
b	18.591 ± 0.007 Å
c	37.278 ± 0.012 Å
α	90°
β	114.121 ± 0.014°
γ	90°
Cell volume	10448 ± 7 Å³
Cell temperature	113 ± 2 K
Ambient diffraction temperature	113 ± 2 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	0.0902
Residual factor for significantly intense reflections	0.0784
Weighted residual factors for significantly intense reflections	0.179
Weighted residual factors for all reflections included in the refinement	0.1883
Goodness-of-fit parameter for all reflections included in the refinement	1.063
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
179469 (current)	2016-03-23	cif/4/33/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/33/66.	4336662.cif
102669	2014-02-21	cif/ Adding structures of 4336662 via cif-deposit CGI script.	4336662.cif