Crystallography Open Database

Information card for entry 4112630

Preview

Coordinates	4112630.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C51 H68.5 Cl5 O3.25 Os P5
Calculated formula	C51 H66 Cl5 O3.25 Os P5
Title of publication	Osmabenzenes from the Reactions of HC\τbCCH(OH)C\τbCH with OsX2(PPh3)3 (X = Cl, Br)
Authors of publication	Haiping Xia; Guomei He; Hong Zhang; Ting Bin Wen; Herman H. Y. Sung; Ian D. Williams; Guochen Jia
Journal of publication	Journal of the American Chemical Society
Year of publication	2004
Journal volume	126
Pages of publication	6862 - 6863
a	11.4923 ± 0.0007 Å
b	14.1998 ± 0.0008 Å
c	17.7994 ± 0.001 Å
α	94.335 ± 0.001°
β	95.037 ± 0.001°
γ	104.761 ± 0.001°
Cell volume	2783.4 ± 0.3 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 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	0.0402
Residual factor for significantly intense reflections	0.0321
Weighted residual factors for significantly intense reflections	0.0675
Weighted residual factors for all reflections included in the refinement	0.07
Goodness-of-fit parameter for all reflections included in the refinement	0.982
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
176467 (current)	2016-02-16	cif/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in range 4.	4112630.cif
120077	2014-07-12	Adding DOIs to range 4/11 structures.	4112630.cif
65039	2012-09-04	cif/ Adding structures of 4112630 via cif-deposit CGI script.	4112630.cif