Information card for entry 2011083

Structure parameters

• Common name: Tetraammonium disodium decavanadate 10-hydrate
• Chemical name: Tetraammonium dinatrium decavanadate 10-hydrate
• Formula: H36 N4 Na2 O38 V10
• Calculated formula: H36 N4 Na2 O38 V10
• SMILES: [V]1234(O[V]5678[O]9[V]%10%11%12([O]%13%14%156[V]6%16(O[V]%17%18%19%13[O]%13%2025[V]2(O1)([O]%18[V]%14(O6)([O]82)(=O)O[V]%15(O%16)(O7)(O%12)=O)(=O)O[V]%20(O4)(O%17)(O[V]9%13(O3)([O]%11%19)=O)=O)(O%10)=O)=O)=O.[Na+].[Na+].O.O.O.O.O.O.O.O.O.O.[NH4+].[NH4+].[NH4+].[NH4+]
• Title of publication: (NH~4~)~4~Na~2~[V~10~O~28~]·10H~2~O
• Authors of publication: Fratzky, Dietmar; Schneider, Matthias; Rabe, Stefan; Meisel, Manfred
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 2000
• Journal volume: 56
• Journal issue: 7
• Pages of publication: 740 - 741
• a: 8.501 ± 0.002 Å
• b: 10.426 ± 0.002 Å
• c: 11.282 ± 0.002 Å
• α: 68.46 ± 0.03°
• β: 87.3 ± 0.03°
• γ: 67.14 ± 0.03°
• Cell volume: 851.7 ± 0.4 ų
• 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: 0.04
• Residual factor for significantly intense reflections: 0.036
• Weighted residual factors for all reflections included in the refinement: 0.102
• Goodness-of-fit parameter for all reflections included in the refinement: 1.063
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes