Crystallography Open Database

Information card for entry 4332264

Preview

Coordinates	4332264.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C22 H52 O2 P2 Ru Si2
Calculated formula	C22 H52 O2 P2 Ru Si2
SMILES	[Ru]12(O[Si](C)(C)C[P]1(C(C)(C)C)C(C)(C)C)O[Si](C)(C)C[P]2(C(C)(C)C)C(C)(C)C
Title of publication	Si−N Bond Hydrolysis Furnishes a Planar 4-Coordinate 14-Electron Ru(II) Complex with a Triplet Ground State
Authors of publication	Walstrom, Amy; Pink, Maren; Caulton, Kenneth G.
Journal of publication	Inorganic Chemistry
Year of publication	2006
Journal volume	45
Journal issue	14
Pages of publication	5617 - 5620
a	8.5097 ± 0.0003 Å
b	9.3073 ± 0.0003 Å
c	10.7481 ± 0.0004 Å
α	69.903 ± 0.001°
β	83.881 ± 0.001°
γ	66.512 ± 0.001°
Cell volume	732.75 ± 0.05 Å³
Cell temperature	130 ± 2 K
Ambient diffraction temperature	130 ± 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	0.0292
Residual factor for significantly intense reflections	0.0262
Weighted residual factors for significantly intense reflections	0.0677
Weighted residual factors for all reflections included in the refinement	0.0703
Goodness-of-fit parameter for all reflections included in the refinement	1.109
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
179425 (current)	2016-03-23	cif/4/33/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/33/22.	4332264.cif
98202	2014-01-29	cif/ Adding structures of 4332264 via cif-deposit CGI script.	4332264.cif