Crystallography Open Database

Information card for entry 1559830

Preview

Coordinates	1559830.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	B2 K2 O7 Pr2
Calculated formula	B2 K2 O7 Pr2
Title of publication	Synthesis and characterization of K2Pr2O(BO3)2: structural, spectroscopic and thermogravimetric investigations of a novel potassium praseodymium oxoborate structure-type
Authors of publication	Chen, Pengyun; Murshed, M. Mangir; Gesing, Thorsten M.
Journal of publication	SN Applied Sciences
Year of publication	2020
Journal volume	2
Journal issue	4
Pages of publication	747
a	11.3377 ± 0.0003 Å
b	6.6047 ± 0.0002 Å
c	10.713 ± 0.0003 Å
α	90°
β	117.072 ± 0.001°
γ	90°
Cell volume	714.32 ± 0.04 Å³
Cell temperature	300 ± 2 K
Ambient diffraction temperature	300 ± 2 K
Number of distinct elements	4
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/c 1
Hall space group symbol	-P 2ybc
Residual factor for all reflections	0.0566
Residual factor for significantly intense reflections	0.0318
Weighted residual factors for significantly intense reflections	0.0401
Weighted residual factors for all reflections included in the refinement	0.0438
Goodness-of-fit parameter for all reflections included in the refinement	1.043
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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