Crystallography Open Database

Information card for entry 7037948

Preview

Coordinates	7037948.cif
Original paper (by DOI)	HTML

Structure parameters

Chemical name	(?5-pentamethylcyclopentadienyl){(N1-(7-chloroquinolin-4-yl)-N2-(pyridin-2-ylmethyl)ethane-1,2-diamine)}chlororhodium(III) chloride
Formula	C28.5 H35 Cl6 N4 Rh
Calculated formula	C28.5 H35 Cl6 N4 Rh
Title of publication	Pentamethylcyclopentadienyl-rhodium and iridium complexes containing (N^N and N^O) bound chloroquine analogue ligands: synthesis, characterization and antimalarial properties.
Authors of publication	Ekengard, Erik; Kumar, Kamlesh; Fogeron, Thibault; de Kock, Carmen; Smith, Peter J.; Haukka, Matti; Monari, Magda; Nordlander, Ebbe
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2016
Journal volume	45
Journal issue	9
Pages of publication	3905 - 3917
a	11.647 ± 0.0006 Å
b	12.1871 ± 0.0005 Å
c	13.4363 ± 0.0005 Å
α	76.108 ± 0.003°
β	89.564 ± 0.004°
γ	61.569 ± 0.005°
Cell volume	1615.34 ± 0.15 Å³
Cell temperature	170 ± 2 K
Ambient diffraction temperature	170 ± 2 K
Number of distinct elements	5
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0468
Residual factor for significantly intense reflections	0.0409
Weighted residual factors for significantly intense reflections	0.0974
Weighted residual factors for all reflections included in the refinement	0.103
Goodness-of-fit parameter for all reflections included in the refinement	1.036
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
177855 (current)	2016-03-05	cif/ Updating files of 7037948, 7037949, 7037950 Original log message: Adding full bibliography for 7037948--7037950.cif.	7037948.cif
174405	2016-01-13	cif/ Adding structures of 7037948, 7037949, 7037950 via cif-deposit CGI script.	7037948.cif