Crystallography Open Database

Information card for entry 1514369

Preview

Coordinates	1514369.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C62 H46 Cl N16 O14 Ru2
Calculated formula	C62 H46 Cl N16 O14 Ru2
Title of publication	A stimuli-responsive "smart probe" for selective monitoring of multiple-cations via differential analyses.
Authors of publication	Kumar, Anup; Singh, Alok K.; Gupta, Tarkeshwar
Journal of publication	The Analyst
Year of publication	2013
Journal volume	138
Journal issue	12
Pages of publication	3356 - 3359
a	19.9067 ± 0.0008 Å
b	20.3667 ± 0.0006 Å
c	18.4436 ± 0.0007 Å
α	90°
β	117.057 ± 0.005°
γ	90°
Cell volume	6659.3 ± 0.5 Å³
Cell temperature	298 ± 2 K
Ambient diffraction temperature	298 ± 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	0.0973
Residual factor for significantly intense reflections	0.0757
Weighted residual factors for significantly intense reflections	0.2285
Weighted residual factors for all reflections included in the refinement	0.2455
Goodness-of-fit parameter for all reflections included in the refinement	1.036
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
176432 (current)	2016-02-14	cif/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries.	1514369.cif
109993	2014-04-18	cif/ Adding structures of 1514369 via cif-deposit CGI script.	1514369.cif