Crystallography Open Database

Information card for entry 4338496

Preview

Coordinates	4338496.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C32 H24 N8 O3 Ru
Calculated formula	C32 H24 N8 O3 Ru
SMILES	c1[n]2c(N=[N](c3ccccc3)[Ru]342(Oc2cccnc2c2ncccc2O4)[n]2ccccc2N=[N]3c2ccccc2)ccc1.O
Title of publication	Significant Influence of Coligands Toward Varying Coordination Modes of 2,2'-Bipyridine-3,3'-diol in Ruthenium Complexes.
Authors of publication	Ghosh, Prabir; Mondal, Prasenjit; Ray, Ritwika; Das, Ankita; Bag, Sukdev; Mobin, Shaikh M.; Lahiri, Goutam Kumar
Journal of publication	Inorganic chemistry
Year of publication	2014
Journal volume	53
Journal issue	12
Pages of publication	6094 - 6106
a	18.758 ± 0.005 Å
b	13.8947 ± 0.0016 Å
c	15.663 ± 0.004 Å
α	90°
β	133.66 ± 0.04°
γ	90°
Cell volume	2953 ± 2 Å³
Cell temperature	150 ± 2 K
Ambient diffraction temperature	150 ± 2 K
Number of distinct elements	5
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	0.0533
Residual factor for significantly intense reflections	0.0451
Weighted residual factors for significantly intense reflections	0.1157
Weighted residual factors for all reflections included in the refinement	0.1254
Goodness-of-fit parameter for all reflections included in the refinement	1.123
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
179487 (current)	2016-03-23	cif/4/33/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/33/84.	4338496.cif
119083	2014-07-05	cif/ Updating files of 4338496, 4338497, 4338498, 4338499 Original log message: Adding full bibliography for 4338496--4338499.cif.	4338496.cif
114374	2014-05-24	cif/ Adding structures of 4338496 via cif-deposit CGI script.	4338496.cif