Crystallography Open Database

Information card for entry 8000514

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Coordinates	8000514.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C56 H43 Eu F9 N3 O8
Calculated formula	C56 H43 Eu F9 N3 O8
Title of publication	Structure Determination of Europium Complexes in Solution Using Crystal-Field Splitting of the Narrow <i>f</i>-<i>f</i> Emission Lines.
Authors of publication	Okayasu, Yoshinori; Yuasa, Junpei
Journal of publication	The journal of physical chemistry letters
Year of publication	2021
Pages of publication	6867 - 6874
a	13.0611 ± 0.001 Å
b	38.48 ± 0.003 Å
c	16.0189 ± 0.0013 Å
α	90°
β	90.703 ± 0.001°
γ	90°
Cell volume	8050.4 ± 1.1 Å³
Cell temperature	173 ± 2 K
Ambient diffraction temperature	173 ± 2 K
Number of distinct elements	6
Space group number	4
Hermann-Mauguin space group symbol	P 1 21 1
Hall space group symbol	P 2yb
Residual factor for all reflections	0.0435
Residual factor for significantly intense reflections	0.0373
Weighted residual factors for significantly intense reflections	0.071
Weighted residual factors for all reflections included in the refinement	0.073
Goodness-of-fit parameter for all reflections included in the refinement	1.063
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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