Crystallography Open Database

Information card for entry 7223064

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Coordinates	7223064.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C45.5 H40 Cl N3 O5 Ru
Calculated formula	C45.5 H40 Cl N3 O5 Ru
Title of publication	Ruthenium hydroxycyclopentadienyl N-heterocyclic carbene complexes as transfer hydrogenation catalysts
Authors of publication	Mazzoni, Rita; Cesari, Cristiana; Cingolani, Andrea; Parise, Chiara; Zacchini, Stefano; Zanotti, Valerio; Cassani, Maria-Cristina
Journal of publication	RSC Adv.
Year of publication	2015
a	34.655 ± 0.003 Å
b	10.7672 ± 0.0008 Å
c	23.2262 ± 0.0018 Å
α	90°
β	100.455 ± 0.008°
γ	90°
Cell volume	8522.7 ± 1.2 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	6
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	0.1462
Residual factor for significantly intense reflections	0.1302
Weighted residual factors for significantly intense reflections	0.3483
Weighted residual factors for all reflections included in the refinement	0.3601
Goodness-of-fit parameter for all reflections included in the refinement	1.049
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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