Crystallography Open Database

Information card for entry 7003227

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Coordinates	7003227.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C25 H54 Cl O P2 Rh
Calculated formula	C25 H54 Cl O P2 Rh
Title of publication	Modelling proposed intermediates in the hydrocarbonylation of alkenes catalysed by rhodium complexes of PBui3 and PPri3
Authors of publication	Cheliatsidou, Paraskevi; White, Daniel F. S.; Slawin, Alexandra M. Z.; Cole-Hamilton, David J.
Journal of publication	Dalton Transactions
Year of publication	2008
Journal issue	18
Pages of publication	2389 - 2394
a	9.3678 ± 0.0014 Å
b	12.7401 ± 0.0018 Å
c	13.0138 ± 0.0019 Å
α	90°
β	101.414 ± 0.002°
γ	90°
Cell volume	1522.4 ± 0.4 Å³
Cell temperature	125 ± 2 K
Ambient diffraction temperature	125 ± 2 K
Number of distinct elements	6
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/c 1
Hall space group symbol	-P 2ybc
Residual factor for all reflections	0.0562
Residual factor for significantly intense reflections	0.0418
Weighted residual factors for significantly intense reflections	0.1042
Weighted residual factors for all reflections included in the refinement	0.1132
Goodness-of-fit parameter for all reflections included in the refinement	1.026
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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