Crystallography Open Database

Information card for entry 4519276

4519275 << 4519276 >> 4519277

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Coordinates	4519276.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C132 Nd4.17 O36.77 Yb5.9
Calculated formula	C132 Nd4.023 O36.5708 Yb5.647
Title of publication	Covert MOF-Based Photoluminescent Tags via Tunable Linker Energetics.
Authors of publication	Deneff, Jacob I.; Rohwer, Lauren E. S.; Butler, Kimberly S.; Valdez, Nichole R.; Rodriguez, Mark A.; Luk, Ting S.; Sava Gallis, Dorina F.
Journal of publication	ACS applied materials & interfaces
Year of publication	2022
Journal volume	14
Journal issue	2
Pages of publication	3038 - 3047
a	21.8128 ± 0.0003 Å
b	21.8128 ± 0.0003 Å
c	16.9894 ± 0.0004 Å
α	90°
β	90°
γ	120°
Cell volume	7000.5 ± 0.2 Å³
Cell temperature	283 K
Ambient diffraction temperature	283 K
Number of distinct elements	4
Space group number	156
Hermann-Mauguin space group symbol	P 3 m 1
Hall space group symbol	P 3 -2"
Residual factor for all reflections	0.0957
Residual factor for significantly intense reflections	0.0735
Weighted residual factors for significantly intense reflections	0.2067
Weighted residual factors for all reflections included in the refinement	0.2415
Goodness-of-fit parameter for all reflections included in the refinement	1.095
Diffraction radiation wavelength	1.54178 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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