Crystallography Open Database

Information card for entry 7049038

Preview

Coordinates	7049038.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C56 H59 B O4 Os P2
Calculated formula	C56 H59 B O4 Os P2
Title of publication	Pentamethylcyclopentadienyl osmium complexes that contain diazoalkane, dioxygen and allenylidene ligands: preparation and reactivity.
Authors of publication	Albertin, Gabriele; Antoniutti, Stefano; Castro, Jesús; Sibilla, Francesca
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2019
Journal volume	48
Journal issue	9
Pages of publication	3116 - 3131
a	17.0342 ± 0.0008 Å
b	16.7169 ± 0.0009 Å
c	18.298 ± 0.001 Å
α	90°
β	104.281 ± 0.002°
γ	90°
Cell volume	5049.5 ± 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	0.0373
Residual factor for significantly intense reflections	0.026
Weighted residual factors for significantly intense reflections	0.0561
Weighted residual factors for all reflections included in the refinement	0.06
Goodness-of-fit parameter for all reflections included in the refinement	1.045
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
224321 (current)	2019-11-08	cif/ Updating files of 7049037, 7049038, 7049039 Original log message: Adding full bibliography for 7049037--7049039.cif.	7049038.cif
213676	2019-02-16	cif/ Adding structures of 7049037, 7049038, 7049039 via cif-deposit CGI script.	7049038.cif