Crystallography Open Database

Information card for entry 7042316

Preview

Coordinates	7042316.cif
Original paper (by DOI)	HTML

Structure parameters

Chemical name	' Chloro-(η^5^-pentamethylcyclopentadienyl)-(quinolin-8-olato)- rhodium'
Formula	C19 H27 Cl N O4 Rh
Calculated formula	C19 H27 Cl N O4 Rh
SMILES	[Rh]12345(Cl)(Oc6cccc7ccc[n]1c67)[c]1([c]2([c]3([c]4([c]51C)C)C)C)C.O.O.O
Title of publication	Comparative solution equilibrium studies of antitumor ruthenium(η(6)-p-cymene) and rhodium(η(5)-C5Me5) complexes of 8-hydroxyquinolines.
Authors of publication	Dömötör, Orsolya; Pape, Veronika F. S.; May, Nóra V; Szakács, Gergely; Enyedy, Éva A
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2017
Journal volume	46
Journal issue	13
Pages of publication	4382 - 4396
a	15.9461 ± 0.0006 Å
b	16.3041 ± 0.0006 Å
c	7.6492 ± 0.0003 Å
α	90°
β	97.132 ± 0.001°
γ	90°
Cell volume	1973.3 ± 0.13 Å³
Cell temperature	103 ± 2 K
Ambient diffraction temperature	103 ± 2 K
Number of distinct elements	6
Space group number	9
Hermann-Mauguin space group symbol	C 1 c 1
Hall space group symbol	C -2yc
Residual factor for all reflections	0.0329
Residual factor for significantly intense reflections	0.0311
Weighted residual factors for significantly intense reflections	0.073
Weighted residual factors for all reflections included in the refinement	0.0739
Goodness-of-fit parameter for all reflections included in the refinement	1.105
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
195068 (current)	2017-04-05	cif/ Updating files of 7042316 Original log message: Adding full bibliography for 7042316.cif.	7042316.cif
193022	2017-03-04	cif/ Adding structures of 7042316 via cif-deposit CGI script.	7042316.cif