Crystallography Open Database

Information card for entry 7717992

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Coordinates	7717992.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C52 H49 Cl N2 O6 P2 Ru
Calculated formula	C50 H41 Cl N2 O4 P2 Ru
Title of publication	Acceptorless oxidant-free dehydrogenation of amines catalyzed by Ru-hydride complexes of amide-acid/ester ligands.
Authors of publication	Yadav, Samanta; Gupta, Rajeev
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2025
Journal volume	54
Journal issue	14
Pages of publication	5675 - 5684
a	11.3027 ± 0.0003 Å
b	12.3655 ± 0.0004 Å
c	17.0464 ± 0.0005 Å
α	82.161 ± 0.002°
β	83.388 ± 0.002°
γ	77.112 ± 0.003°
Cell volume	2291.87 ± 0.12 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	7
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0493
Residual factor for significantly intense reflections	0.0416
Weighted residual factors for significantly intense reflections	0.0966
Weighted residual factors for all reflections included in the refinement	0.1004
Goodness-of-fit parameter for all reflections included in the refinement	1.04
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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