Crystallography Open Database

Information card for entry 2219832

2219831 << 2219832 >> 2219833

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Structure parameters

Chemical name	<i>rac</i>-Carbonyl{1- [(diphenylphosphino)methyl]ethanethiolato}(triphenylphosphine)rhodium(I)
Formula	C34 H31 O P2 Rh S
Calculated formula	C34 H31 O P2 Rh S
Title of publication	<i>rac</i>-Carbonyl{1-[(diphenylphosphino)methyl]ethanethiolato}(triphenylphosphine)rhodium(I)
Authors of publication	Hernández-Ortega, Simón; Morales-Morales, David
Journal of publication	Acta Crystallographica Section E
Year of publication	2008
Journal volume	64
Journal issue	11
Pages of publication	m1465
a	10.3142 ± 0.0007 Å
b	16.865 ± 0.001 Å
c	34.984 ± 0.002 Å
α	90°
β	90°
γ	90°
Cell volume	6085.4 ± 0.6 Å³
Cell temperature	298 ± 2 K
Ambient diffraction temperature	298 ± 2 K
Number of distinct elements	6
Space group number	61
Hermann-Mauguin space group symbol	P b c a
Hall space group symbol	-P 2ac 2ab
Residual factor for all reflections	0.0739
Residual factor for significantly intense reflections	0.0491
Weighted residual factors for significantly intense reflections	0.0993
Weighted residual factors for all reflections included in the refinement	0.1081
Goodness-of-fit parameter for all reflections included in the refinement	1.059
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	Yes

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