Crystallography Open Database





Information card for 8103306

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Coordinates

8103306.cif

Structure parameters

Formula - B H6 K Mn O11 P2 -
Calculated formula - B H6 K Mn O11 P2 -
Title of publication Crystal structure of potassium diaquamanganese(II) borophosphate monohydrate, K[Mn(H2O)2(BP2O8)] · H2O
Authors of publication Ming-Zhen Wang
Journal of publication Zeitschrift für Kristallographie - New Crystal Structures
Year of publication 2012
Journal volume 227
Journal issue 1
Pages of publication 3
a 9.683 ± 0.004 Å
b 9.683 ± 0.004 Å
c 16.139 ± 0.006 Å
α 90°
β 90°
γ 120°
Cell volume 1310.5 ± 0.9 Å3
Cell temperature 293 ± 2 K
Ambient diffraction temperature 293 ± 2 K
Number of distinct elements 6
Hermann-Mauguin symmetry space group P 65 2 2
Hall symmetry space group P 65 2 (0 0 1)
Residual factor for all reflections 0.0604
Residual factor for observed reflections 0.0566
Weighted residual factors for the observed reflections 0.1754
Weighted residual factors for all reflections included in the refinement 0.1817
Goodness-of-fit parameter for observed reflections 1.006
Diffraction radiation wavelength 0.71073 Å
Diffraction radiation type MoKα
Has coordinates Yes
Has disorder No
Has Fobs No

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