Crystallography Open Database

Information card for entry 7714002

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Coordinates	7714002.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C21 H16 N O13 Tb
Calculated formula	C21 H16 N O13 Tb
Title of publication	U-type π-conjugated phosphorescent ligand sensitized lanthanide metal–organic frameworks for efficient white-light-emitting diode
Authors of publication	Chen, Ying-Jun; Dou, Chang-Xun; Yin, Pei-Pei; Chen, Jun-Ting; Yang, Xiao-Gang; Li, Bo; Ma, Lufang; Wang, Liya
Journal of publication	Dalton Transactions
Year of publication	2023
a	9.1936 ± 0.0005 Å
b	9.4195 ± 0.0004 Å
c	14.1041 ± 0.0006 Å
α	79.17 ± 0.004°
β	84.543 ± 0.004°
γ	65.593 ± 0.005°
Cell volume	1092.23 ± 0.1 Å³
Cell temperature	294.5 K
Ambient diffraction temperature	294.5 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	0.0351
Residual factor for significantly intense reflections	0.0313
Weighted residual factors for significantly intense reflections	0.0556
Weighted residual factors for all reflections included in the refinement	0.0583
Goodness-of-fit parameter for all reflections included in the refinement	1.038
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

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