Crystallography Open Database

Information card for entry 4325869

Preview

Coordinates	4325869.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C33.3 H46.6 B9 Cl P2 Ru
Calculated formula	C33.3 H46.6 B9 Cl P2 Ru
Title of publication	Carborane Complexes of Ruthenium(III): Studies on Thermal Reaction Chemistry and the Catalyst Design for Atom Transfer Radical Polymerization of Methyl Methacrylate
Authors of publication	Ivan D. Grishin; Dmitrii I. D'yachihin; Alexander V. Piskunov; Fedor M. Dolgushin; Alexander F. Smol'yakov; Mikhail M. Il'in; Vadim A. Davankov; Igor T. Chizhevsky; Dmitry F. Grishin
Journal of publication	Inorganic Chemistry
Year of publication	2011
Journal volume	50
Pages of publication	7574 - 7585
a	12.4511 ± 0.0005 Å
b	18.6812 ± 0.0007 Å
c	30.6394 ± 0.0012 Å
α	90°
β	90.765 ± 0.001°
γ	90°
Cell volume	7126.1 ± 0.5 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 2 K
Number of distinct elements	6
Space group number	15
Hermann-Mauguin space group symbol	C 1 2/c 1
Hall space group symbol	-C 2yc
Residual factor for all reflections	0.0441
Residual factor for significantly intense reflections	0.0325
Weighted residual factors for significantly intense reflections	0.07
Weighted residual factors for all reflections included in the refinement	0.074
Goodness-of-fit parameter for all reflections included in the refinement	1.022
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
176467 (current)	2016-02-16	cif/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in range 4.	4325869.cif
91935	2013-12-29	cod/ (saulius@koala.ibt.lt) Adding DOIs that could be assigned unambiguously to the rest of COD CIFs.	4325869.cif
46905	2012-03-21	../uploads/cif-deposit/cod/cif Adding structures of 4325869 via cif-deposit CGI script.	4325869.cif