Crystallography Open Database

Information card for entry 7702862

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Coordinates	7702862.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C40 H53 Cu Gd N10 O12
Calculated formula	C40 H49 Cu Gd N10 O12
Title of publication	Structural characterisation, EPR and magnetic properties of f‒f and f‒d lanthanide(iii) phenolic cryptates
Authors of publication	Avecilla, Fernando; Platas-Iglesias, Carlos; Rodríguez-Cortiñas, Raquel; Guillemot, Geoffroy; Bünzli, Jean-Claude G.; Brondino, Carlos D.; Geraldes, Carlos F. G. C.; Blas, Andrés de; Rodríguez-Blas, Teresa
Journal of publication	Journal of the Chemical Society, Dalton Transactions
Year of publication	2002
Journal issue	24
Pages of publication	4658
a	33.359 ± 0.003 Å
b	11.0095 ± 0.0009 Å
c	25.614 ± 0.002 Å
α	90°
β	104.55 ± 0.002°
γ	90°
Cell volume	9105.5 ± 1.3 Å³
Cell temperature	173 ± 2 K
Ambient diffraction temperature	173 ± 2 K
Number of distinct elements	6
Space group number	15
Hermann-Mauguin space group symbol	C 1 2/c 1
Hall space group symbol	-C 2yc
Residual factor for all reflections	0.1469
Residual factor for significantly intense reflections	0.0581
Weighted residual factors for significantly intense reflections	0.1304
Weighted residual factors for all reflections included in the refinement	0.1693
Goodness-of-fit parameter for all reflections included in the refinement	0.981
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
244052 (current)	2019-11-28	cif/ Adding structures of 7702860, 7702861, 7702862, 7702863, 7702864 via cif-deposit CGI script.	7702862.cif