Crystallography Open Database

Information card for entry 4001373

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Coordinates	4001373.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C9 H15 Na O25 P Pr3
Calculated formula	C9 H3 Na O25 P Pr3
Title of publication	Synthesis, Structural Characterization, and Luminescence Properties of Lanthanide Oxalatophosphonates: Na[M3(H2O)4(C2O4)4(CH3PO3)]·2H2O (M = Nd and Pr)
Authors of publication	Huang, Ya-Ling; Huang, Meow-Yu; Chan, Tsung-Han; Chang, Bor-Chen; Lii, Kwang-Hwa
Journal of publication	Chemistry of Materials
Year of publication	2007
Journal volume	19
Journal issue	13
Pages of publication	3232
a	9.1254 ± 0.0011 Å
b	9.5493 ± 0.0012 Å
c	14.0728 ± 0.0017 Å
α	75.086 ± 0.002°
β	86.611 ± 0.002°
γ	82.545 ± 0.002°
Cell volume	1174.6 ± 0.2 Å³
Cell temperature	296 ± 2 K
Ambient diffraction temperature	296 ± 2 K
Number of distinct elements	6
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0385
Residual factor for significantly intense reflections	0.0308
Weighted residual factors for significantly intense reflections	0.0663
Weighted residual factors for all reflections included in the refinement	0.0681
Goodness-of-fit parameter for all reflections included in the refinement	0.981
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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