Crystallography Open Database

Information card for entry 4307768

Preview

Coordinates	4307768.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C112 H108 B4 Cl4 Fe4 N52 Ni4 O28
Calculated formula	C112 H108 B4 Cl4 Fe4 N52 Ni4 O28
Title of publication	Cyano-Bridged FeIII2CuII3 and FeIII4NiII4 Complexes: Syntheses, Structures, and Magnetic Properties
Authors of publication	Zhi-Guo Gu; Wei Liu; Qiao-Fang Yang; Xin-Hui Zhou; Jing-Lin Zuo; Xiao-Zeng You
Journal of publication	Inorganic Chemistry
Year of publication	2007
Journal volume	46
Pages of publication	3236 - 3244
a	18.6771 ± 0.0016 Å
b	30.5524 ± 0.0016 Å
c	52.567 ± 0.003 Å
α	90°
β	90°
γ	90°
Cell volume	29996 ± 3 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	8
Space group number	70
Hermann-Mauguin space group symbol	F d d d :2
Hall space group symbol	-F 2uv 2vw
Residual factor for all reflections	0.1136
Residual factor for significantly intense reflections	0.0667
Weighted residual factors for significantly intense reflections	0.1366
Weighted residual factors for all reflections included in the refinement	0.1459
Goodness-of-fit parameter for all reflections included in the refinement	1.014
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
179115 (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 4/30/77.	4307768.cif
120081	2014-07-12	Adding DOIs to range 4/30 structures.	4307768.cif
34330	2012-02-24	cif/4/ Reorganising CIF range 4 into a prefix tree.	4307768.cif
1194	2010-06-06	cif/4/ Adding data from Inorg-Chem-2007_01-13/ processing directory.	4307768.cif