Crystallography Open Database

Information card for entry 7714245

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Coordinates	7714245.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C32 H40 Cl O P Rh Si2
Calculated formula	C32 H40 Cl O P Rh Si2
Title of publication	Unexpected alkyl isomerization at the silicon ligand of an unsaturated Rh complex: combined experiment and theory
Authors of publication	Abeynayake, Niroshani S.; Le, Nghia; Sanchez-Lecuona, Gabriela; Donnadieu, Bruno; Webster, Charles Edwin; Montiel-Palma, Virginia
Journal of publication	Dalton Transactions
Year of publication	2023
a	9.844 ± 0.005 Å
b	11.815 ± 0.007 Å
c	13.809 ± 0.008 Å
α	102.799 ± 0.015°
β	95 ± 0.02°
γ	97.929 ± 0.016°
Cell volume	1539.6 ± 1.5 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 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	0.0519
Residual factor for significantly intense reflections	0.043
Weighted residual factors for significantly intense reflections	0.1067
Weighted residual factors for all reflections included in the refinement	0.1129
Goodness-of-fit parameter for all reflections included in the refinement	1.027
Diffraction radiation wavelength	1.54178 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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