Crystallography Open Database

Information card for entry 4065906

Preview

Coordinates	4065906.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C38 H56 O3 P2 Ru
Calculated formula	C38 H55 O3 P2 Ru
SMILES	[Ru]12([P](c3c(O1)cccc3)(C(C)(C)C)C(C)(C)C)([P](c1ccccc1O2)(C(C)(C)C)C(C)(C)C)=Cc1c(OC(C)C)cccc1
Title of publication	Tuning the Steric Properties of a Metathesis Catalyst for Copolymerization of Norbornene and Cyclooctene toward Complete Alternation
Authors of publication	Torker, Sebastian; Müller, Andre; Sigrist, Raphael; Chen, Peter
Journal of publication	Organometallics
Year of publication	2010
Journal volume	29
Journal issue	12
Pages of publication	2735
a	18.9553 ± 0.0003 Å
b	9.6848 ± 0.0002 Å
c	21.1832 ± 0.0005 Å
α	90°
β	101.091 ± 0.0008°
γ	90°
Cell volume	3816.15 ± 0.13 Å³
Cell temperature	173 K
Number of distinct elements	5
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	0.0781
Residual factor for significantly intense reflections	0.0615
Weighted residual factors for significantly intense reflections	0.1701
Weighted residual factors for all reflections included in the refinement	0.1824
Goodness-of-fit parameter for all reflections included in the refinement	1.232
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/4065906.html