Crystallography Open Database

Information card for entry 4116297

Preview

Coordinates	4116297.cif
Original paper (by DOI)	HTML

Structure parameters

Chemical name	1,2-{(C5Me5)Ru}2B3H9
Formula	C20 H39 B3 Ru2
Calculated formula	C20 H30 B3 Ru2
Title of publication	Chemistry of Dimetallaboranes Derived from the Reaction of [CpMCl2]2 with Monoboranes (M = Ru, Rh; Cp = η5-C5Me5)
Authors of publication	Xinjian Lei; Maoyu Shang; Thomas P. Fehlner
Journal of publication	Journal of the American Chemical Society
Year of publication	1999
Journal volume	121
Pages of publication	1275 - 1287
a	11.372 ± 0.002 Å
b	14.061 ± 0.003 Å
c	15.233 ± 0.003 Å
α	90°
β	103.12 ± 0.03°
γ	90°
Cell volume	2372.2 ± 0.9 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	4
Space group number	15
Hermann-Mauguin space group symbol	C 1 2/c 1
Hall space group symbol	-C 2yc
Residual factor for all reflections	0.0736
Residual factor for significantly intense reflections	0.0657
Weighted residual factors for significantly intense reflections	0.1804
Weighted residual factors for all reflections included in the refinement	0.1885
Goodness-of-fit parameter for all reflections included in the refinement	1.093
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
178933 (current)	2016-03-22	cif/4/11/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/11/62.	4116297.cif
70907	2013-01-11	cif/ Adding structures of 4116297 via cif-deposit CGI script.	4116297.cif