Crystallography Open Database

Information card for entry 4303163

Preview

Coordinates	4303163.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C116 H144 Cl10 Fe5 N68 O40
Calculated formula	C116 H144 Cl10 Fe5 N68 O40
Title of publication	Structures and Spin States of Bis(tridentate)-Type Mononuclear and Triple Helicate Dinuclear Iron(II) Complexes of Imidazole-4-carbaldehyde azine
Authors of publication	Yukinari Sunatsuki; Ryohei Kawamoto; Kunihiro Fujita; Hisashi Maruyama; Takayoshi Suzuki; Hiroyuki Ishida; Masaaki Kojima; Seiichiro Iijima; Naohide Matsumoto
Journal of publication	Inorganic Chemistry
Year of publication	2009
Journal volume	48
Pages of publication	8784 - 8795
a	22.8537 ± 0.0012 Å
b	22.8537 ± 0.0011 Å
c	31.4028 ± 0.0015 Å
α	90°
β	90°
γ	90°
Cell volume	16401.4 ± 1.4 Å³
Cell temperature	200.1 K
Number of distinct elements	6
Space group number	88
Hermann-Mauguin space group symbol	I 41/a :2
Hall space group symbol	-I 4ad
Residual factor for significantly intense reflections	0.072
Weighted residual factors for all reflections included in the refinement	0.206
Goodness-of-fit parameter for all reflections included in the refinement	1.065
Diffraction radiation wavelength	0.71075 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
176467 (current)	2016-02-16	cif/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in range 4.	4303163.cif
120081	2014-07-12	Adding DOIs to range 4/30 structures.	4303163.cif
34330	2012-02-24	cif/4/ Reorganising CIF range 4 into a prefix tree.	4303163.cif
1125	2010-04-25	cif/4/ Adding CIFs for the Inorg-Chem-2009_11-24 deposition.	4303163.cif