Crystallography Open Database

Information card for entry 7113057

Preview

Coordinates	7113057.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C22.5 H19.75 N5 O3.88 Ru
Calculated formula	C22.5 H19.5 N5 O3.875 Ru
Title of publication	Addition of [CH(CN)2]- and [TCNE]˙- to Ru(VI)≡N bearing 8-quinolinolato ligands.
Authors of publication	Leung, Chi-Fai; Yiu, Shek-Man; Xiang, Jing; Lau, Tai-Chu
Journal of publication	Chemical communications (Cambridge, England)
Year of publication	2010
Journal volume	46
Journal issue	40
Pages of publication	7575 - 7577
a	31.568 ± 0.0002 Å
b	31.568 ± 0.0002 Å
c	11.1516 ± 0.0002 Å
α	90°
β	90°
γ	90°
Cell volume	11113 ± 0.2 Å³
Cell temperature	173 ± 2 K
Ambient diffraction temperature	173 ± 2 K
Number of distinct elements	5
Space group number	82
Hermann-Mauguin space group symbol	I -4
Hall space group symbol	I -4
Residual factor for all reflections	0.0421
Residual factor for significantly intense reflections	0.035
Weighted residual factors for significantly intense reflections	0.1043
Weighted residual factors for all reflections included in the refinement	0.107
Goodness-of-fit parameter for all reflections included in the refinement	1.086
Diffraction radiation wavelength	1.54178 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
176453 (current)	2016-02-16	cif/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in range 7.	7113057.cif
112226	2014-04-30	cif/ Adding structures of 7113056, 7113057, 7113058 via cif-deposit CGI script.	7113057.cif