Crystallography Open Database

Information card for entry 4084753

Preview

Coordinates	4084753.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C83 H70 Cl4 N2 O Os P4 S2
Calculated formula	C83 H70 Cl4 N2 O Os P4 S2
Title of publication	Synthesis, Structure, and Reactivity of an Osmacyclopentene Complex
Authors of publication	Han, Feifei; Wang, Tongdao; Li, Jinhua; Zhang, Hong; Zhang, Laiying; He, Xumin; Xia, Haiping
Journal of publication	Organometallics
Year of publication	2014
Journal volume	33
Journal issue	19
Pages of publication	5301
a	13.7115 ± 0.0006 Å
b	14.1888 ± 0.0007 Å
c	19.7024 ± 0.0009 Å
α	80.249 ± 0.004°
β	89.522 ± 0.004°
γ	75.278 ± 0.004°
Cell volume	3651.3 ± 0.3 Å³
Cell temperature	173 ± 2 K
Ambient diffraction temperature	173 ± 2 K
Number of distinct elements	8
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0766
Residual factor for significantly intense reflections	0.0555
Weighted residual factors for significantly intense reflections	0.1206
Weighted residual factors for all reflections included in the refinement	0.1338
Goodness-of-fit parameter for all reflections included in the refinement	1
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
178736 (current)	2016-03-21	cif/4/08/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/08/47.	4084753.cif
126812	2014-11-11	cif/ Adding structures of 4084749, 4084750, 4084751, 4084752, 4084753 via cif-deposit CGI script.	4084753.cif