Crystallography Open Database

Information card for entry 7046119

Preview

Coordinates	7046119.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C37 H46 Cl2 N2 O Ru
Calculated formula	C37 H46 Cl2 N2 O Ru
Title of publication	Stable ruthenium olefin metathesis catalysts bearing symmetrical NHC ligands with primary and secondary N-alkyl groups.
Authors of publication	Ambrosio, Chiara; Paradiso, Veronica; Costabile, Chiara; Bertolasi, Valerio; Caruso, Tonino; Grisi, Fabia
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2018
Journal volume	47
Journal issue	18
Pages of publication	6615 - 6627
a	10.6467 ± 0.0001 Å
b	22.5668 ± 0.0005 Å
c	15.5514 ± 0.0004 Å
α	90°
β	93.659 ± 0.0013°
γ	90°
Cell volume	3728.79 ± 0.13 Å³
Cell temperature	295 K
Ambient diffraction temperature	295 K
Number of distinct elements	6
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/c 1
Hall space group symbol	-P 2ybc
Residual factor for all reflections	0.0647
Residual factor for significantly intense reflections	0.0367
Weighted residual factors for significantly intense reflections	0.0845
Weighted residual factors for all reflections included in the refinement	0.093
Goodness-of-fit parameter for all reflections included in the refinement	1.012
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
229868 (current)	2019-11-17	cif/ Updating files of 7046119 Original log message: Adding full bibliography for 7046119.cif.	7046119.cif
207497	2018-04-27	cif/ Adding structures of 7046119 via cif-deposit CGI script.	7046119.cif