Crystallography Open Database

Information card for entry 7708973

Preview

Coordinates	7708973.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C32 H36 Cl2 N4 O2.5 P Ru
Calculated formula	C32 H36 Cl2 N4 O2.5 P Ru
Title of publication	Novel ruthenium complexes bearing bipyridine-based and N-heterocyclic carbene-supported pyridine (NCN) ligands: the influence of ligands on catalytic transfer hydrogenation of ketones.
Authors of publication	Piyasaengthong, Akkharadet; Williams, Luke J.; Yufit, Dmitry S.; Walton, James W.
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2021
Journal volume	51
Journal issue	1
Pages of publication	340 - 351
a	19.9245 ± 0.0009 Å
b	11.0559 ± 0.0005 Å
c	30.7401 ± 0.0014 Å
α	90°
β	107.531 ± 0.002°
γ	90°
Cell volume	6457 ± 0.5 Å³
Cell temperature	120 K
Ambient diffraction temperature	120 K
Number of distinct elements	7
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	0.058
Residual factor for significantly intense reflections	0.0404
Weighted residual factors for significantly intense reflections	0.098
Weighted residual factors for all reflections included in the refinement	0.1024
Goodness-of-fit parameter for all reflections included in the refinement	1.071
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
272644 (current)	2022-02-04	cif/ Updating files of 7708973, 7708974, 7708975, 7708976 Original log message: Adding full bibliography for 7708973--7708976.cif.	7708973.cif
270950	2021-12-01	cif/ Adding structures of 7708973, 7708974, 7708975, 7708976 via cif-deposit CGI script.	7708973.cif