Crystallography Open Database

Information card for entry 7702752

Preview

Coordinates	7702752.cif
Original paper (by DOI)	HTML

Structure parameters

Chemical name	octaaquatris(chloranilato)dilutetium(III) hydrate
Formula	C18 H24 Cl6 Lu2 O24
Calculated formula	C18 Cl6 Lu2 O24
Title of publication	Dihydroxybenzoquinone and chloranilic acid derivatives of rare earth metals
Authors of publication	Abrahams, Brendan F.; Coleiro, Joseph; Ha, Karen; Hoskins, Bernard F.; Orchard, Simon D.; Robson, Richard
Journal of publication	Journal of the Chemical Society, Dalton Transactions
Year of publication	2002
Journal issue	8
Pages of publication	1586
a	18.956 ± 0.008 Å
b	16.68 ± 0.005 Å
c	10.97 ± 0.004 Å
α	90°
β	110.97 ± 0.03°
γ	90°
Cell volume	3239 ± 2 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	5
Space group number	12
Hermann-Mauguin space group symbol	C 1 2/m 1
Hall space group symbol	-C 2y
Residual factor for all reflections	0.1557
Residual factor for significantly intense reflections	0.0859
Weighted residual factors for significantly intense reflections	0.1932
Weighted residual factors for all reflections included in the refinement	0.2303
Goodness-of-fit parameter for all reflections included in the refinement	1.022
Diffraction radiation wavelength	0.71069 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
243998 (current)	2019-11-28	cif/ Adding structures of 7702740, 7702741, 7702742, 7702743, 7702744, 7702745, 7702746, 7702747, 7702748, 7702749, 7702750, 7702751, 7702752, 7702753, 7702754, 7702755 via cif-deposit CGI script.	7702752.cif