Crystallography Open Database

Information card for entry 4335630

Preview

Coordinates	4335630.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C56 H64 Mo4 O12 P6 Re2
Calculated formula	C56 H64 Mo4 O12 P6 Re2
Title of publication	Reactivity of the Anionic Diphosphorus Complex [Mo2Cp2(μ-PCy2)(μ-κ2:κ2-P2)(CO)2]- toward Phosphorus- and Transition Metal-Based Electrophiles
Authors of publication	M. Angeles Alvarez; M. Esther García; Daniel García-Vivó; Raquel Lozano; Alberto Ramos; Miguel A. Ruiz
Journal of publication	Inorganic Chemistry
Year of publication	2013
Journal volume	52
Pages of publication	9005 - 9018
a	22.0385 ± 0.0012 Å
b	18.5783 ± 0.0007 Å
c	19.1055 ± 0.001 Å
α	90°
β	117.887 ± 0.007°
γ	90°
Cell volume	6914.1 ± 0.7 Å³
Cell temperature	150 ± 2 K
Ambient diffraction temperature	150 ± 2 K
Number of distinct elements	6
Space group number	15
Hermann-Mauguin space group symbol	C 1 2/c 1
Hall space group symbol	-C 2yc
Residual factor for all reflections	0.0748
Residual factor for significantly intense reflections	0.0585
Weighted residual factors for significantly intense reflections	0.1501
Weighted residual factors for all reflections included in the refinement	0.162
Goodness-of-fit parameter for all reflections included in the refinement	1.055
Diffraction radiation probe	x-ray
Diffraction radiation wavelength	1.54184 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
179459 (current)	2016-03-23	cif/4/33/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/33/56.	4335630.cif
101565	2014-02-14	cif/ Adding structures of 4335630 via cif-deposit CGI script.	4335630.cif