Information card for entry 2106331

Structure parameters

• Chemical name: Na6 (Mo5 P2 O23) (H2 O)14
• Formula: H28 Mo5 Na6 O37 P2
• Calculated formula: Mo5 Na6 O37 P2
• SMILES: [Mo]123(O[Mo]45(O[Mo]67(O[Mo]89(O[Mo](=O)(=O)(O1)([O]8P(=O)(O7)[O]35)[O]2P(=O)([O]69)O4)(=O)=O)(=O)=O)(=O)=O)(=O)=O.[Na+].O.[Na+].O.O.O.[Na+].O.O.O.[Na+].O.O.[Na+].O.O.O.[Na+].O.O
• Title of publication: Multicomponent polyanions. 16. The molecular and crystal structure of Na6 Mo5 P2 O23 (H2 O)14 , a compound containing sodium-coordinated pentamolybdodiphosphate anions
• Authors of publication: Hedman, B.
• Journal of publication: Acta Crystallographica B (24,1968-38,1982)
• Year of publication: 1977
• Journal volume: 33
• Pages of publication: 3083 - 3090
• a: 15.8304 Å
• b: 19.876 Å
• c: 10.6828 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 3361.29 ų
• Number of distinct elements: 5
• Space group number: 19
• Hermann-Mauguin space group symbol: P 21 21 21
• Hall space group symbol: P 2ac 2ab
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No