Crystallography Open Database

Information card for entry 7216644

Preview

Coordinates	7216644.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C28 H30 Cl2 N3 P Ru
Calculated formula	C28 H30 Cl2 N3 P Ru
Title of publication	Ruthenium complexes of tetradentate bipyridine ligands: highly efficient catalysts for the hydrogenation of carboxylic esters and lactones
Authors of publication	Li, Wei; Xie, Jian-Hua; Yuan, Ming-Lei; Zhou, Qi-Lin
Journal of publication	Green Chemistry
Year of publication	2014
Journal volume	16
Journal issue	9
Pages of publication	4081
a	11.8935 ± 0.0005 Å
b	13.1976 ± 0.0006 Å
c	33.9681 ± 0.0016 Å
α	90°
β	90°
γ	90°
Cell volume	5331.8 ± 0.4 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	6
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	0.0705
Residual factor for significantly intense reflections	0.0659
Weighted residual factors for significantly intense reflections	0.1255
Weighted residual factors for all reflections included in the refinement	0.1273
Goodness-of-fit parameter for all reflections included in the refinement	1.293
Diffraction radiation wavelength	0.71075 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
180497 (current)	2016-03-26	cif/7/21/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/21/66.	7216644.cif
123491	2014-09-08	cif/ Updating files of 7216644 Original log message: Adding full bibliography for 7216644.cif.	7216644.cif
117687	2014-06-15	cif/ Adding structures of 7216644 via cif-deposit CGI script.	7216644.cif