Crystallography Open Database

Information card for entry 2023253

2023252 << 2023253 >> 2023254

Preview

Coordinates	2023253.cif
Original IUCr paper	HTML

Structure parameters

Common name	Indium(III)[5-nonanoyl-8-hydroxyquinolinate]dichloride monohydrate
Chemical name	Bis(μ~2~-5-nonanoylquinolin-8-olato)bis[aquadichloridoindium(III)]
Formula	C36 H48 Cl4 In2 N2 O6
Calculated formula	C36 H48 Cl4 In2 N2 O6
Title of publication	Crystal structure of bis(μ2-5-nonanoylquinolin-8-olato)bis[aquadichloridoindium(III)]
Authors of publication	Fuhrmann, Betty; Meier, Eric; Mazik, Monika
Journal of publication	Acta Crystallographica Section E Crystallographic Communications
Year of publication	2024
Journal volume	80
Journal issue	10
a	10.297 ± 0.004 Å
b	10.94 ± 0.004 Å
c	11.711 ± 0.005 Å
α	63.57 ± 0.03°
β	72.47 ± 0.03°
γ	62.92 ± 0.03°
Cell volume	1043.8 ± 0.8 Å³
Cell temperature	163 ± 2 K
Ambient diffraction temperature	163 ± 2 K
Number of distinct elements	6
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0713
Residual factor for significantly intense reflections	0.0388
Weighted residual factors for significantly intense reflections	0.0555
Weighted residual factors for all reflections included in the refinement	0.0606
Goodness-of-fit parameter for all reflections included in the refinement	0.879
Diffraction radiation probe	x-ray
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
294842 (current)	2024-09-21	cif/ Adding structures of 2023253 via cif-deposit CGI script.	2023253.cif