Crystallography Open Database

Information card for entry 4084042

Preview

Coordinates	4084042.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C64 H119 Cl4 P4 Ru2
Calculated formula	C64 H119 Cl4 P4 Ru2
Title of publication	Deactivation of Ruthenium Metathesis Catalysts via Facile Formation of Face-Bridged Dimers
Authors of publication	Amoroso, Dino; Yap, Glenn P. A.; Fogg, Deryn E.
Journal of publication	Organometallics
Year of publication	2002
Journal volume	21
Journal issue	16
Pages of publication	3335
a	11.7069 ± 0.0016 Å
b	14.1411 ± 0.0019 Å
c	22.14 ± 0.003 Å
α	95.066 ± 0.003°
β	93.018 ± 0.002°
γ	112.186 ± 0.002°
Cell volume	3365.9 ± 0.8 Å³
Cell temperature	203 ± 2 K
Ambient diffraction temperature	203 ± 2 K
Number of distinct elements	5
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.1076
Residual factor for significantly intense reflections	0.054
Weighted residual factors for significantly intense reflections	0.103
Weighted residual factors for all reflections included in the refinement	0.1126
Goodness-of-fit parameter for all reflections included in the refinement	1.038
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
178729 (current)	2016-03-21	cif/4/08/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/08/40.	4084042.cif
120644	2014-07-22	cif/ Adding structures of 4084041, 4084042 via cif-deposit CGI script.	4084042.cif