Crystallography Open Database

Information card for entry 4303160

Preview

Coordinates	4303160.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C61 H89 B8 F32 Fe4 N49 O27
Calculated formula	C61 H84 B8 F32 Fe4 N49 O27
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	11.5903 ± 0.0007 Å
b	15.5367 ± 0.001 Å
c	17.4994 ± 0.001 Å
α	90.2947 ± 0.0018°
β	90.2919 ± 0.0018°
γ	108.508 ± 0.0018°
Cell volume	2988.1 ± 0.3 Å³
Cell temperature	173.1 K
Number of distinct elements	7
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for significantly intense reflections	0.0682
Weighted residual factors for all reflections included in the refinement	0.2158
Goodness-of-fit parameter for all reflections included in the refinement	1.045
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.	4303160.cif
120081	2014-07-12	Adding DOIs to range 4/30 structures.	4303160.cif
34330	2012-02-24	cif/4/ Reorganising CIF range 4 into a prefix tree.	4303160.cif
1125	2010-04-25	cif/4/ Adding CIFs for the Inorg-Chem-2009_11-24 deposition.	4303160.cif