Crystallography Open Database

Information card for entry 7225346

Preview

Coordinates	7225346.cif
Original paper (by DOI)	HTML

Structure parameters

Chemical name	cis-[RuCl2(dppp)(bipy)]
Formula	C37 H34 Cl2 N2 P2 Ru
Calculated formula	C37 H34 Cl2 N2 P2 Ru
SMILES	c1cccc2c3cccc[n]3[Ru]3(Cl)(Cl)([P](c4ccccc4)(c4ccccc4)CCC[P]3(c3ccccc3)c3ccccc3)[n]12
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	10.826 ± 0.001 Å
b	30.221 ± 0.002 Å
c	21.141 ± 0.002 Å
α	90°
β	94.401 ± 0.004°
γ	90°
Cell volume	6896.4 ± 1 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 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	0.2611
Residual factor for significantly intense reflections	0.0896
Weighted residual factors for significantly intense reflections	0.1498
Weighted residual factors for all reflections included in the refinement	0.194
Goodness-of-fit parameter for all reflections included in the refinement	1.009
Diffraction radiation probe	x-ray
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
193656 (current)	2017-03-04	cif/7: Fixing Z values and formulae	7225346.cif
183096	2016-05-27	cif/ Adding structures of 7225344, 7225345, 7225346 via cif-deposit CGI script.	7225346.cif