Crystallography Open Database

Information card for entry 7057400

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Coordinates	7057400.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C58 H62 Er2 N8 O14
Calculated formula	C58 H62 Er2 N8 O14
Title of publication	Regulating the luminescent and magnetic properties of rare-earth complexes with β-diketonate coligands
Authors of publication	Chu, Xiao-Ya; Wang, Wen-Min; Nie, Yao-Yao; Cui, Jian-Zhong; Gao, Hong-Ling
Journal of publication	New Journal of Chemistry
Year of publication	2018
Journal volume	42
Journal issue	14
Pages of publication	11417
a	9.4246 ± 0.0019 Å
b	24.17 ± 0.005 Å
c	13.79 ± 0.003 Å
α	90°
β	109.7 ± 0.03°
γ	90°
Cell volume	2957.4 ± 1.2 Å³
Cell temperature	113 ± 2 K
Ambient diffraction temperature	113.15 K
Number of distinct elements	5
Space group number	4
Hermann-Mauguin space group symbol	P 1 21 1
Hall space group symbol	P 2yb
Residual factor for all reflections	0.0497
Residual factor for significantly intense reflections	0.0445
Weighted residual factors for significantly intense reflections	0.1067
Weighted residual factors for all reflections included in the refinement	0.1197
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	No
Has F_obs	No

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