Crystallography Open Database

Information card for entry 4323356

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Structure parameters

Formula	C28 H20 Cr2 O6
Calculated formula	C224 H160 Cr16 O48
Title of publication	Heterobimetallic Complexes with Phenylcyclopentadienyl Ligand: Syntheses and Structures of Tricarbonylchromium-η6,η5-Phenylcyclopentadienyl-Transition Metal Complexes1
Authors of publication	Changtao Qian; Jianhua Guo; Jie Sun; Jian Chen; Peiju Zheng
Journal of publication	Inorganic Chemistry
Year of publication	1997
Journal volume	36
Pages of publication	1286 - 1295
a	29.616 ± 0.008 Å
b	12.861 ± 0.005 Å
c	12.397 ± 0.007 Å
α	90°
β	90°
γ	90°
Cell volume	4722 ± 3 Å³
Cell temperature	20 K
Ambient diffraction temperature	20 K
Number of distinct elements	4
Space group number	61
Hermann-Mauguin space group symbol	P b c a
Hall space group symbol	-P 2ac 2ab
Residual factor for significantly intense reflections	0.045
Weighted residual factors for significantly intense reflections	0.045
Goodness-of-fit parameter for significantly intense reflections	1.36
Diffraction radiation wavelength	0.7107 Å
Diffraction radiation type	MoKalpha
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
301838 (current)	2025-08-21	Add cross-references to PubChem compounds in COD range 4/32/ Each referenced PubChem compound corresponds to the full crystal structure.	4323356.cif
176467	2016-02-16	cif/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in range 4.	4323356.cif
120105	2014-07-12	Adding DOIs to range 4/32 structures.	4323356.cif
34330	2012-02-24	cif/4/ Reorganising CIF range 4 into a prefix tree.	4323356.cif
23384	2011-08-07	../uploads/cif-deposit/cod/cif Adding structures of 4323356 via cif-deposit CGI script.	4323356.cif