Crystallography Open Database

Information card for entry 7040540

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Coordinates	7040540.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C42 H37 Cl O2 P Rh
Calculated formula	C42 H37 Cl O2 P Rh
Title of publication	A comparison of MOP-phosphonite ligands and their applications in Rh(i)- and Pd(ii)-catalysed asymmetric transformations.
Authors of publication	Fleming, James T.; Wills, Corinne; Waddell, Paul G.; Harrington, Ross W.; Higham, Lee J.
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2016
Journal volume	45
Journal issue	39
Pages of publication	15660 - 15670
a	10.46454 ± 0.0001 Å
b	18.62602 ± 0.00018 Å
c	18.5228 ± 0.0002 Å
α	90°
β	92.093 ± 0.0009°
γ	90°
Cell volume	3607.92 ± 0.06 Å³
Cell temperature	150 ± 0.2 K
Ambient diffraction temperature	150 ± 0.2 K
Number of distinct elements	6
Space group number	4
Hermann-Mauguin space group symbol	P 1 21 1
Hall space group symbol	P 2yb
Residual factor for all reflections	0.0439
Residual factor for significantly intense reflections	0.034
Weighted residual factors for significantly intense reflections	0.0763
Weighted residual factors for all reflections included in the refinement	0.0802
Goodness-of-fit parameter for all reflections included in the refinement	1.06
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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