Information card for entry 2203141

Structure parameters

• Chemical name: tetrapotassium sodium hydrogendecavanadate decahydrate
• Formula: H21 K4 Na O38 V10
• Calculated formula: K4 Na O38 V10
• SMILES: [V]12345O[V]678(O[V]9%10%11(O[V]%12%13%14%15[O]%16%17%184[V]4%19(O[V]%20%16(O1)(O[V]1%18(O4)([O]3[V](O6)(O9)([O]%141)([O]58%10%15[V]1([O]2[V]%17(O%19)(O%20)(=O)[O]%131)(O7)(O%11)=O)=O)=O)=O)(O%12)=O)=O)=O.[K+].[K+].O.[K+].O.[K+].O.[Na+].O.O.O.O.O.O.O
• Title of publication: A novel monoprotonated decavanadate, K~4~Na[HV~10~O~28~]·10H~2~O
• Authors of publication: Lee, Uk; Joo, Hea-Chung
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2004
• Journal volume: 60
• Journal issue: 2
• Pages of publication: i22 - i24
• a: 10.804 ± 0.002 Å
• b: 11.034 ± 0.002 Å
• c: 13.748 ± 0.003 Å
• α: 90°
• β: 95.78 ± 0.02°
• γ: 90°
• Cell volume: 1630.6 ± 0.6 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 2 K
• Number of distinct elements: 5
• Space group number: 13
• Hermann-Mauguin space group symbol: P 1 2/n 1
• Hall space group symbol: -P 2yac
• Residual factor for all reflections: 0.0726
• Residual factor for significantly intense reflections: 0.046
• Weighted residual factors for significantly intense reflections: 0.1076
• Weighted residual factors for all reflections included in the refinement: 0.1282
• Goodness-of-fit parameter for all reflections included in the refinement: 1.145
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No