Crystallography Open Database

Information card for entry 4108746

Preview

Coordinates	4108746.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C31 H32 F Ga I2 O2 P Ru
Calculated formula	C31 H32 F Ga I2 O2 P Ru
Title of publication	Cationic Terminal Gallylene Complexes by Halide Abstraction: Coordination Chemistry of a Valence Isoelectronic Analogue of CO and N2
Authors of publication	Natalie D. Coombs; Dragoslav Vidovic; Joanna K. Day; Amber L. Thompson; Delphine D. Le Pevelen; Andreas Stasch; William Clegg; Luca Russo; Louise Male; Michael B. Hursthouse; David J. Willock; Simon Aldridge
Journal of publication	Journal of the American Chemical Society
Year of publication	2008
Journal volume	130
Pages of publication	16111 - 16124
a	10.8243 ± 0.0002 Å
b	11.0082 ± 0.0002 Å
c	15.2923 ± 0.0003 Å
α	73.8264 ± 0.0008°
β	69.7145 ± 0.0007°
γ	85.1463 ± 0.0009°
Cell volume	1641.36 ± 0.05 Å³
Cell temperature	150 K
Ambient diffraction temperature	150 K
Number of distinct elements	8
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0463
Residual factor for significantly intense reflections	0.0352
Weighted residual factors for all reflections	0.0854
Weighted residual factors for significantly intense reflections	0.0814
Weighted residual factors for all reflections included in the refinement	0.0854
Goodness-of-fit parameter for all reflections included in the refinement	0.991
Diffraction radiation wavelength	0.71073 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.	4108746.cif
120076	2014-07-11	Adding DOIs to range 4/10 structures.	4108746.cif
57114	2012-05-16	cif/ Adding structures of 4108746 via cif-deposit CGI script.	4108746.cif