Crystallography Open Database

Information card for entry 7023128

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Coordinates	7023128.cif
Original paper (by DOI)	HTML

Structure parameters

Common name	Calcium Uranyl Phosphite
Formula	Ca1.81 O21 P4 U2.19
Calculated formula	Ca1.81 O21 P4 U2.19
Title of publication	Structural changes within the alkaline earth uranyl phosphites.
Authors of publication	Villa, Eric M.; Diwu, Juan; Alekseev, Evgeny V.; Depmeier, Wulf; Albrecht-Schmitt, Thomas E
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2013
Journal volume	42
Journal issue	26
Pages of publication	9637 - 9644
a	22.8646 ± 0.0015 Å
b	6.6182 ± 0.0003 Å
c	7.0309 ± 0.0004 Å
α	90°
β	94.762 ± 0.004°
γ	90°
Cell volume	1060.26 ± 0.1 Å³
Cell temperature	103 ± 2 K
Ambient diffraction temperature	103 ± 2 K
Number of distinct elements	4
Space group number	5
Hermann-Mauguin space group symbol	C 1 2 1
Hall space group symbol	C 2y
Residual factor for all reflections	0.055
Residual factor for significantly intense reflections	0.0404
Weighted residual factors for significantly intense reflections	0.0802
Weighted residual factors for all reflections included in the refinement	0.0842
Goodness-of-fit parameter for all reflections included in the refinement	0.945
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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