Information card for entry 2006343

Structure parameters

• Formula: C20 H38 Mo5 N4 O23 P2
• Calculated formula: C20 H34 Mo5 N4 O23 P2
• Title of publication: Bis(piperazinium) Pentakis(trioxomolybdo)bis(phenylphosphonate) Dihydrate
• Authors of publication: Harrison, William T. A.; Dussack, Laurie L.; Jacobson, Allan J.
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 1997
• Journal volume: 53
• Journal issue: 7
• Pages of publication: 856 - 859
• a: 13.133 ± 0.004 Å
• b: 18.932 ± 0.006 Å
• c: 14.646 ± 0.009 Å
• α: 90°
• β: 95.7 ± 0.03°
• γ: 90°
• Cell volume: 3623 ± 3 ų
• Cell temperature: 298 K
• Ambient diffraction temperature: 298 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/a 1
• Hall space group symbol: -P 2yab
• Residual factor for all reflections: 0.022
• Residual factor for significantly intense reflections: 0.022
• Weighted residual factors for all reflections: 0.035
• Weighted residual factors for significantly intense reflections: 0.035
• Goodness-of-fit parameter for significantly intense reflections: 1.84
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes