Crystallography Open Database

Information card for entry 7054710

Preview

Coordinates	7054710.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C36 H42 Cl2 N8 O10 Ru S
Calculated formula	C36 H42 Cl2.001 N8 O10 Ru S
Title of publication	Supramolecular architecture and photophysical and biological properties of ruthenium(ii) polypyridyl complexes
Authors of publication	Bhat, Satish S.; Revankar, Vidyanand K.; Khan, Ayesha; Butcher, Raymond J.; Thatipamula, Krishnachary
Journal of publication	New J. Chem.
Year of publication	2015
Journal volume	39
Journal issue	5
Pages of publication	3646
a	11.0785 ± 0.0012 Å
b	11.9068 ± 0.0013 Å
c	16.6733 ± 0.0018 Å
α	76.422 ± 0.002°
β	75.205 ± 0.002°
γ	79.014 ± 0.002°
Cell volume	2047 ± 0.4 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 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	0.0951
Residual factor for significantly intense reflections	0.0786
Weighted residual factors for significantly intense reflections	0.1781
Weighted residual factors for all reflections included in the refinement	0.1863
Goodness-of-fit parameter for all reflections included in the refinement	1.112
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
180101 (current)	2016-03-26	cif/7/05/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/05/47.	7054710.cif
138807	2015-06-07	cif/ Updating files of 7054710 Original log message: Adding full bibliography for 7054710.cif.	7054710.cif
132476	2015-02-26	cif/ Adding structures of 7054710 via cif-deposit CGI script.	7054710.cif