Crystallography Open Database

Information card for entry 4082151

Preview

Coordinates	4082151.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C51 H50 Cl6 N4 O2 Ru2
Calculated formula	C51 H50 Cl6 N4 O2 Ru2
Title of publication	Neutral and Ionic Cycloruthenated 2-Phenylindoles as Cytotoxic Agents
Authors of publication	Belsa, Lluís; López, Concepción; González, Asensio; Font-Bard\?ía, Mercè; Calvet, Teresa; Calvis, Carmen; Messeguer, Ramon
Journal of publication	Organometallics
Year of publication	2013
Journal volume	32
Journal issue	24
Pages of publication	7264
a	11.07 ± 0.05 Å
b	30.339 ± 0.017 Å
c	7.947 ± 0.006 Å
α	90°
β	98.07 ± 0.04°
γ	90°
Cell volume	2643 ± 12 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	6
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/c 1
Hall space group symbol	-P 2ybc
Residual factor for all reflections	0.1444
Residual factor for significantly intense reflections	0.0434
Weighted residual factors for significantly intense reflections	0.0825
Weighted residual factors for all reflections included in the refinement	0.0996
Goodness-of-fit parameter for all reflections included in the refinement	0.821
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
178710 (current)	2016-03-21	cif/4/08/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/08/21.	4082151.cif
92196	2014-01-12	cif/ Adding structures of 4082150, 4082151 via cif-deposit CGI script.	4082151.cif