Crystallography Open Database

Information card for entry 4321699

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Coordinates	4321699.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C52 H48 Cl2 F12 P6 Re
Calculated formula	C52 H48 Cl2 F12 P6 Re
Title of publication	Ethanol Oxidation by Imidorhenium(V) Complexes: Formation of Amidorhenium(III) Complexes
Authors of publication	Annette L. Suing; Charlotte R. Dewan; Peter S. White; H. Holden Thorp
Journal of publication	Inorganic Chemistry
Year of publication	2000
Journal volume	39
Pages of publication	6080 - 6085
a	11.1953 ± 0.0006 Å
b	13.3364 ± 0.0007 Å
c	16.9539 ± 0.0009 Å
α	90°
β	96.763 ± 0.001°
γ	90°
Cell volume	2513.7 ± 0.2 Å³
Cell temperature	193 K
Ambient diffraction temperature	193 K
Number of distinct elements	6
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	0.048
Residual factor for significantly intense reflections	0.04
Weighted residual factors for all reflections	0.066
Weighted residual factors for significantly intense reflections	0.065
Goodness-of-fit parameter for significantly intense reflections	2.64
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MolybdenumKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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