Crystallography Open Database

Information card for entry 1563925

Preview

Coordinates	1563925.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C106 H156 Gd2 N10 O6
Calculated formula	C106 H156 Gd2 N10 O6
Title of publication	Structural and spectroscopic investigations of redox active seven coordinate luminescent lanthanide complexes
Authors of publication	Molloy, Jennifer K.; Fedele, Lionel; Jarjayes, Olivier; Philouze, Christian; Imbert, Daniel; Thomas, Fabrice
Journal of publication	Inorganica Chimica Acta
Year of publication	2018
Journal volume	483
Pages of publication	609 - 617
a	16.392 ± 0.003 Å
b	17.851 ± 0.004 Å
c	20.793 ± 0.004 Å
α	92.94 ± 0.03°
β	109.29 ± 0.03°
γ	112.25 ± 0.03°
Cell volume	5206 ± 3 Å³
Cell temperature	200 K
Ambient diffraction temperature	200 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	0.0491
Residual factor for significantly intense reflections	0.0334
Weighted residual factors for significantly intense reflections	0.0769
Weighted residual factors for all reflections included in the refinement	0.0923
Goodness-of-fit parameter for all reflections included in the refinement	1.212
Diffraction radiation probe	x-ray
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
266989 (current)	2021-07-05	cif/ Adding structures of 1563925, 1563926, 1563927, 1563928 via cif-deposit CGI script.	1563925.cif