Crystallography Open Database

Information card for entry 7242736

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Coordinates	7242736.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C49 H40 N2 O4 P2 Ru
Calculated formula	C49 H40 N2 O4 P2 Ru
Title of publication	Dual utility of a single diphosphine‒ruthenium complex: a precursor for new complexes and, a pre-catalyst for transfer-hydrogenation and Oppenauer oxidation
Authors of publication	Mukherjee, Aparajita; Bhattacharya, Samaresh
Journal of publication	RSC Advances
Year of publication	2021
Journal volume	11
Journal issue	26
Pages of publication	15617 - 15631
a	10.0627 ± 0.0004 Å
b	10.8128 ± 0.0004 Å
c	20.1657 ± 0.0008 Å
α	76.224 ± 0.002°
β	79.05 ± 0.003°
γ	84.212 ± 0.003°
Cell volume	2088.67 ± 0.14 Å³
Cell temperature	296 ± 2 K
Ambient diffraction temperature	296 ± 2 K
Number of distinct elements	6
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0997
Residual factor for significantly intense reflections	0.0537
Weighted residual factors for significantly intense reflections	0.1273
Weighted residual factors for all reflections included in the refinement	0.1518
Goodness-of-fit parameter for all reflections included in the refinement	0.943
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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