Crystallography Open Database

Information card for entry 7047493

Preview

Coordinates	7047493.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C36 H32 N2 O10 Ru3
Calculated formula	C36 H32 N2 O10 Ru3
Title of publication	Preparation of the Ru<sub>3</sub>(CO)<sub>8</sub>-pyridine-alcohol cluster and its use for the selective catalytic transformation of primary to secondary amines.
Authors of publication	Singh, Ajeet; Mobin, Shaikh M.; Mathur, Pradeep
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2018
Journal volume	47
Journal issue	39
Pages of publication	14033 - 14040
a	18.6183 ± 0.0004 Å
b	11.7709 ± 0.0002 Å
c	17.3349 ± 0.0002 Å
α	90°
β	107.923 ± 0.002°
γ	90°
Cell volume	3614.65 ± 0.11 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	5
Space group number	15
Hermann-Mauguin space group symbol	I 1 2/a 1
Hall space group symbol	-I 2ya
Residual factor for all reflections	0.0268
Residual factor for significantly intense reflections	0.0255
Weighted residual factors for significantly intense reflections	0.065
Weighted residual factors for all reflections included in the refinement	0.0661
Goodness-of-fit parameter for all reflections included in the refinement	1.052
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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