Crystallography Open Database

Information card for entry 4340534

Preview

Coordinates	4340534.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C66 H76 F6 N8 O8 Ru S2
Calculated formula	C66 H76 F6 N8 O8 Ru S2
Title of publication	4,4',5,5'-Tetracarboxy-2,2'-bipyridine Ru(II) Sensitizers for Dye-Sensitized Solar Cells.
Authors of publication	Chou, Chun-Cheng; Hu, Fa-Chun; Wu, Kuan-Lin; Duan, Tainan; Chi, Yun; Liu, Shih-Hung; Lee, Gene-Hsiang; Chou, Pi-Tai
Journal of publication	Inorganic chemistry
Year of publication	2014
Journal volume	53
Journal issue	16
Pages of publication	8593 - 8599
a	14.2187 ± 0.0009 Å
b	14.5385 ± 0.0011 Å
c	18.28 ± 0.0012 Å
α	104.225 ± 0.003°
β	102.416 ± 0.003°
γ	103.392 ± 0.003°
Cell volume	3412 ± 0.4 Å³
Cell temperature	150 ± 2 K
Ambient diffraction temperature	150 ± 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	0.1291
Residual factor for significantly intense reflections	0.0666
Weighted residual factors for significantly intense reflections	0.1536
Weighted residual factors for all reflections included in the refinement	0.1873
Goodness-of-fit parameter for all reflections included in the refinement	1.013
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
179508 (current)	2016-03-23	cif/4/34/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/34/05.	4340534.cif
122882	2014-09-06	cif/ Updating files of 4340534 Original log message: Adding full bibliography for 4340534.cif.	4340534.cif
120878	2014-07-30	cif/ Adding structures of 4340534 via cif-deposit CGI script.	4340534.cif