Crystallography Open Database

Information card for entry 4001163

Preview

Coordinates	4001163.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C H5 O7 P Yb
Calculated formula	C H5 O7 P Yb
Title of publication	Luminescent Lanthanide Oxalatophosphites with a 3D Framework Structure: [Ln(H2O)(C2O4)0.5(HPO3)]·H2O (Ln = Pr, Nd, and Sm−Lu)
Authors of publication	Wang, Chih-Min; Wu, Yi-Ying; Chang, Yu-Wei; Lii, Kwang-Hwa
Journal of publication	Chemistry of Materials
Year of publication	2008
Journal volume	20
Journal issue	9
Pages of publication	2857
a	6.4075 ± 0.0005 Å
b	6.805 ± 0.0007 Å
c	7.6647 ± 0.0008 Å
α	111.753 ± 0.002°
β	95.858 ± 0.002°
γ	91.204 ± 0.001°
Cell volume	308.16 ± 0.05 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 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	0.0345
Residual factor for significantly intense reflections	0.0291
Weighted residual factors for significantly intense reflections	0.0638
Weighted residual factors for all reflections included in the refinement	0.0649
Goodness-of-fit parameter for all reflections included in the refinement	1.075
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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