Information card for entry 2217680

Structure parameters

• Chemical name: Triammonium hexahydroxidooctadecaoxidohexamolybdogallate(III) heptahydrate
• Formula: Ga H32 Mo6 N3 O31
• Calculated formula: Ga H6 Mo6 N3 O31
• SMILES: [OH]12[Ga]3456[OH]7[Mo]81(O[Mo]12([OH]6[Mo]2([OH]5[Mo]5([OH]4[Mo]4([OH]3[Mo]7(O8)(O4)(=O)=O)(=O)(=O)O5)(O2)(=O)=O)(O1)(=O)=O)(=O)=O)(=O)=O.[NH4+].[NH4+].[NH4+].O.O.O.O.O.O.O
• Title of publication: Triammonium hexahydroxidooctadecaoxidohexamolybdogallate(III) heptahydrate
• Authors of publication: Mensinger, Zachary L.; Zakharov, Lev N.; Johnson, Darren W.
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2008
• Journal volume: 64
• Journal issue: 2
• Pages of publication: i8 - i9
• a: 22.7642 ± 0.0015 Å
• b: 10.9651 ± 0.0007 Å
• c: 11.7599 ± 0.0008 Å
• α: 90°
• β: 100.212 ± 0.001°
• γ: 90°
• Cell volume: 2888.9 ± 0.3 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0533
• Residual factor for significantly intense reflections: 0.0399
• Weighted residual factors for significantly intense reflections: 0.0996
• Weighted residual factors for all reflections included in the refinement: 0.1095
• Goodness-of-fit parameter for all reflections included in the refinement: 1.17
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes