Crystallography Open Database

Information card for entry 4089165

Preview

Coordinates	4089165.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C54.88 H43.75 Cl1.75 N4 Os P2
Calculated formula	C54.875 H43.75 Cl1.75 N4 Os P2
Title of publication	Osmium(II) Complexes Containing a Dianionic CCCC-Donor Tetradentate Ligand
Authors of publication	Alabau, Roberto G.; Esteruelas, Miguel A.; Oliván, Montserrat; Oñate, Enrique; Palacios, Adrián U.; Tsai, Jui-Yi; Xia, Chuanjun
Journal of publication	Organometallics
Year of publication	2016
Journal volume	35
Journal issue	23
Pages of publication	3981
a	12.324 ± 0.006 Å
b	19.843 ± 0.01 Å
c	19.987 ± 0.01 Å
α	81.267 ± 0.007°
β	75.348 ± 0.006°
γ	88.797 ± 0.007°
Cell volume	4673 ± 4 Å³
Cell temperature	150 ± 2 K
Ambient diffraction temperature	150 ± 2 K
Number of distinct elements	6
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0465
Residual factor for significantly intense reflections	0.0352
Weighted residual factors for significantly intense reflections	0.0947
Weighted residual factors for all reflections included in the refinement	0.1011
Goodness-of-fit parameter for all reflections included in the refinement	1.037
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
238011 (current)	2019-11-24	cif/ Adding structures of 4089163, 4089164, 4089165, 4089166, 4089167, 4089168 via cif-deposit CGI script.	4089165.cif