Crystallography Open Database

Information card for entry 4074812

Preview

Coordinates	4074812.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C23 H36 B F4 Os P
Calculated formula	C23 H36 B F4 Os P
Title of publication	Preparation of Half-Sandwich Osmium-Allyl Complexes by Consecutive C−C Bond Formation and C−H Bond Activation Reactions
Authors of publication	Esteruelas, Miguel A.; González, Ana I.; López, Ana M.; Oliván, Montserrat; Oñate, Enrique
Journal of publication	Organometallics
Year of publication	2006
Journal volume	25
Journal issue	3
Pages of publication	693
a	10.2094 ± 0.0013 Å
b	12.8248 ± 0.0017 Å
c	17.944 ± 0.002 Å
α	90°
β	96.363 ± 0.002°
γ	90°
Cell volume	2335 ± 0.5 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 2 K
Number of distinct elements	6
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/n 1
Hall space group symbol	-P 2yn
Residual factor for all reflections	0.0371
Residual factor for significantly intense reflections	0.0271
Weighted residual factors for significantly intense reflections	0.0591
Weighted residual factors for all reflections included in the refinement	0.0608
Goodness-of-fit parameter for all reflections included in the refinement	0.974
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
178637 (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 4/07/48.	4074812.cif
120075	2014-07-11	Adding DOIs to range 4/07 structures.	4074812.cif
48845	2012-03-27	../uploads/cif-deposit/cod/cif Adding structures of 4074811, 4074812, 4074813 via cif-deposit CGI script.	4074812.cif