Crystallography Open Database

Information card for entry 4326684

Preview

Coordinates	4326684.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C45.5 H45 F6 N5 O3 P Ru
Calculated formula	C44.9 H43.8 F6.06 N5 O2.8 P1.01 Ru
Title of publication	Polydentate Analogues of 8-Hydroxyquinoline and Their Complexes with Ruthenium
Authors of publication	Maya El Ojaimi; Randolph P. Thummel
Journal of publication	Inorganic Chemistry
Year of publication	2011
Journal volume	50
Pages of publication	10966 - 10973
a	9.203 ± 0.002 Å
b	15.11 ± 0.003 Å
c	16.64 ± 0.003 Å
α	103.302 ± 0.003°
β	98.448 ± 0.003°
γ	99.987 ± 0.003°
Cell volume	2175.2 ± 0.8 Å³
Cell temperature	223 ± 2 K
Ambient diffraction temperature	223 ± 2 K
Number of distinct elements	7
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.1097
Residual factor for significantly intense reflections	0.0588
Weighted residual factors for significantly intense reflections	0.1631
Weighted residual factors for all reflections included in the refinement	0.217
Goodness-of-fit parameter for all reflections included in the refinement	1.091
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.	4326684.cif
91935	2013-12-29	cod/ (saulius@koala.ibt.lt) Adding DOIs that could be assigned unambiguously to the rest of COD CIFs.	4326684.cif
49458	2012-03-27	../uploads/cif-deposit/cod/cif Adding structures of 4326684 via cif-deposit CGI script.	4326684.cif