Crystallography Open Database

Information card for entry 4071903

4071902 << 4071903 >> 4071904

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Coordinates	4071903.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C29 H35 Cl N O6 Os P
Calculated formula	C29 H35 Cl N O6 Os P
Title of publication	Osmium-Catalyzed Allylic Alkylation
Authors of publication	Esteruelas, Miguel A.; García-Yebra, Cristina; Oliván, Montserrat; Oñate, Enrique; Valencia, Marta
Journal of publication	Organometallics
Year of publication	2008
Journal volume	27
Journal issue	19
Pages of publication	4892
a	17.82 ± 0.003 Å
b	16.545 ± 0.002 Å
c	19.229 ± 0.003 Å
α	90°
β	90°
γ	90°
Cell volume	5669.3 ± 1.5 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 2 K
Number of distinct elements	7
Space group number	61
Hermann-Mauguin space group symbol	P b c a
Hall space group symbol	-P 2ac 2ab
Residual factor for all reflections	0.0716
Residual factor for significantly intense reflections	0.0526
Weighted residual factors for significantly intense reflections	0.098
Weighted residual factors for all reflections included in the refinement	0.1039
Goodness-of-fit parameter for all reflections included in the refinement	1.195
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
178608 (current)	2016-03-21	cif/4/07/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/07/19.	4071903.cif
91935	2013-12-29	cod/ (saulius@koala.ibt.lt) Adding DOIs that could be assigned unambiguously to the rest of COD CIFs.	4071903.cif
47256	2012-03-23	cif/4/ Distributing the new range 4 CIFs into their appropriate prefixed subdirectories.	4071903.cif
44104	2012-03-15	../uploads/cif-deposit/cod/cif Adding structures of 4071900, 4071901, 4071902, 4071903 via cif-deposit CGI script.	4071903.cif