Crystallography Open Database

Information card for entry 7225344

Preview

Coordinates	7225344.cif
Original paper (by DOI)	HTML

Structure parameters

Common name	cis-[RuCl(CH3OH)(dppb)(bipy)](PF6)
Chemical name	CBMet
Formula	C40 H44 Cl F6 N2 O2 P3 Ru
Calculated formula	C40 H44 Cl F6 N2 O2 P3 Ru
Title of publication	Influence of gold nanoparticles applied to catalytic hydrogenation of acetophenone with cationic complexes containing ruthenium
Authors of publication	Souza, Lanarck C.; Santos, Thiago A.; do Prado, Cássio R.A.; Lima, Benedito A. V.; Correa, Rodrigo S.; Batista, Alzir A.; Otubo, Larissa; Ellena, Javier A.; Ueno, Leonardo Tsuyoshi; Dinelli, Luís Rogério; Bogado, André Luiz
Journal of publication	RSC Adv.
Year of publication	2016
a	18.8352 ± 0.0011 Å
b	19.9178 ± 0.0007 Å
c	21.3951 ± 0.0006 Å
α	90°
β	90°
γ	90°
Cell volume	8026.5 ± 0.6 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	8
Space group number	61
Hermann-Mauguin space group symbol	P b c a
Hall space group symbol	-P 2ac 2ab
Residual factor for all reflections	0.0815
Residual factor for significantly intense reflections	0.0516
Weighted residual factors for significantly intense reflections	0.1303
Weighted residual factors for all reflections included in the refinement	0.1464
Goodness-of-fit parameter for all reflections included in the refinement	1.022
Diffraction radiation probe	x-ray
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
183096 (current)	2016-05-27	cif/ Adding structures of 7225344, 7225345, 7225346 via cif-deposit CGI script.	7225344.cif