Crystallography Open Database

Information card for entry 4023223

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Coordinates	4023223.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C51 H54 B Cl2 F4 Fe P Rh
Calculated formula	C50.974 H53.948 B Cl1.948 F4 Fe P2 Rh
Title of publication	Bis-(2,5-diphenylphospholanes) with sp^2^ Carbon Linkers: Synthesis and Application in Asymmetric Hydrogenation
Authors of publication	Martin E. Fox; Mark Jackson; Ian C. Lennon; Jerzy Klosin; Khalil A. Abboud
Journal of publication	Journal of Organic Chemistry
Year of publication	2008
Journal volume	73
Pages of publication	775 - 784
a	10.9694 ± 0.0006 Å
b	18.716 ± 0.001 Å
c	11.0478 ± 0.0006 Å
α	90°
β	96.885 ± 0.001°
γ	90°
Cell volume	2251.8 ± 0.2 Å³
Cell temperature	173 ± 2 K
Ambient diffraction temperature	173 ± 2 K
Number of distinct elements	8
Space group number	4
Hermann-Mauguin space group symbol	P 1 21 1
Hall space group symbol	P 2yb
Residual factor for all reflections	0.0234
Residual factor for significantly intense reflections	0.0228
Weighted residual factors for significantly intense reflections	0.0583
Weighted residual factors for all reflections included in the refinement	0.0587
Goodness-of-fit parameter for all reflections included in the refinement	1.041
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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