Information card for entry 4031636

Structure parameters

• Chemical name: Na H3 V W12 O40 (H2 O)13
• Formula: H29 Na O53 V W12
• Calculated formula: Na O53 V W12
• SMILES: O=[V]([O-])([O-])[O-].O=[W]123O[W]45(=O)O[W]67(O[W]8(O1)(=O)O[W]1(O7)(O[W]79(O[W](=O)(O6)(O5)O[W]5(O[W]6(O[W](=O)(O2)(O8)O[W](O6)(O7)(O1)=O)(=O)O[W](O4)(O3)(O5)=O)(O9)=O)=O)=O)=O.[Na+].O.O.O.O.O.O.O.O.O.O.O.O.O
• Title of publication: Synthesis and Structure of a New Heteropolytungstate with a Central Vanadium(IV) Atom
• Authors of publication: Revenco, M.D.; Petrenko, P.A.; Kozlenko, A.A.; Simonov, Yu.A.; Wael Abu Dayyih; Lipkowski, J.; Grosu, P.N.
• Journal of publication: Russian Journal of Inorganic Chemistry (= Zhurnal Neorganicheskoi Khimii)
• Year of publication: 2003
• Journal volume: 48
• Pages of publication: 322 - 322
• a: 14.0361 Å
• b: 14.0729 Å
• c: 14.112 Å
• α: 118.136°
• β: 93.2658°
• γ: 111.104°
• Cell volume: 2204.4 ų
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No