Crystallography Open Database

Information card for entry 7702980

Preview

Coordinates	7702980.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C45 H39 N7
Calculated formula	C45 H39 N7
Title of publication	Synthesis and antiproliferative activity of benzimidazole-based, trinuclear neutral cyclometallated and cationic, N<sup>^</sup>N-chelated ruthenium(ii) complexes.
Authors of publication	Welsh, Athi; Rylands, Laa-Iqa; Arion, Vladimir B.; Prince, Sharon; Smith, Gregory S.
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2020
Journal volume	49
Journal issue	4
Pages of publication	1143 - 1156
a	15.9799 ± 0.001 Å
b	15.9799 ± 0.001 Å
c	15.7925 ± 0.0009 Å
α	90°
β	90°
γ	120°
Cell volume	3492.4 ± 0.4 Å³
Cell temperature	173 ± 2 K
Ambient diffraction temperature	173 ± 2 K
Number of distinct elements	3
Space group number	165
Hermann-Mauguin space group symbol	P -3 c 1
Hall space group symbol	-P 3 2"c
Residual factor for all reflections	0.0515
Residual factor for significantly intense reflections	0.0391
Weighted residual factors for significantly intense reflections	0.093
Weighted residual factors for all reflections included in the refinement	0.1016
Goodness-of-fit parameter for all reflections included in the refinement	1.031
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
247724 (current)	2020-02-04	cif/ Updating files of 7702979, 7702980 Original log message: Adding full bibliography for 7702979--7702980.cif.	7702980.cif
245297	2019-12-18	cif/ Adding structures of 7702979, 7702980 via cif-deposit CGI script.	7702980.cif