Crystallography Open Database

Information card for entry 4075359

Preview

Coordinates	4075359.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C29 H41 B10 N Ru
Calculated formula	C29 H35 B10 N Ru
Title of publication	Reaction of [η5:σ-Me2C(C5H4)(C2B10H10)]Ru(NH2Prn)2with Alkynes. Synthesis and Structural Characterization of Ruthenium Aminocarbene and Enamine Complexes
Authors of publication	Sun, Yi; Chan, Hoi-Shan; Xie, Zuowei
Journal of publication	Organometallics
Year of publication	2006
Journal volume	25
Journal issue	14
Pages of publication	3447
a	10.5914 ± 0.0005 Å
b	13.1936 ± 0.0006 Å
c	22.4714 ± 0.001 Å
α	90°
β	90°
γ	90°
Cell volume	3140.1 ± 0.2 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	5
Space group number	19
Hermann-Mauguin space group symbol	P 21 21 21
Hall space group symbol	P 2ac 2ab
Residual factor for all reflections	0.0651
Residual factor for significantly intense reflections	0.0494
Weighted residual factors for significantly intense reflections	0.1193
Weighted residual factors for all reflections included in the refinement	0.1333
Goodness-of-fit parameter for all reflections included in the refinement	1.062
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
178642 (current)	2016-03-21	cif/4/07/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/07/53.	4075359.cif
120075	2014-07-11	Adding DOIs to range 4/07 structures.	4075359.cif
49205	2012-03-27	../uploads/cif-deposit/cod/cif Adding structures of 4075359, 4075360, 4075361, 4075362, 4075363 via cif-deposit CGI script.	4075359.cif