Crystallography Open Database

Information card for entry 4021721

Preview

Coordinates	4021721.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C10 H22 N2 O2 Os
Calculated formula	C10 H22 N2 O2 Os
SMILES	C1N(C(C)(C)C)[Os](=O)(N(C1)C(C)(C)C)=O
Title of publication	New Osmium-Based Reagent for the Dihydroxylation of Alkenes
Authors of publication	Timothy J. Donohoe; Robert M. Harris; Sam Butterworth; Jeremy N. Burrows; Andrew Cowley; Jeremy S. Parker
Journal of publication	Journal of Organic Chemistry
Year of publication	2006
Journal volume	71
Pages of publication	4481 - 4489
a	6.1505 ± 0.0002 Å
b	12.5027 ± 0.0002 Å
c	16.6071 ± 0.0003 Å
α	90°
β	90°
γ	90°
Cell volume	1277.05 ± 0.05 Å³
Cell temperature	150 K
Ambient diffraction temperature	150 K
Number of distinct elements	5
Space group number	60
Hermann-Mauguin space group symbol	P b c n
Hall space group symbol	-P 2n 2ab
Residual factor for all reflections	0.0341
Residual factor for significantly intense reflections	0.0225
Weighted residual factors for all reflections	0.0348
Weighted residual factors for significantly intense reflections	0.0302
Weighted residual factors for all reflections included in the refinement	0.0302
Goodness-of-fit parameter for all reflections included in the refinement	1.0531
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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