Information card for entry 4300966

Structure parameters

• Formula: H8 Na12 Nb12 O46 Si Ti2
• Calculated formula: Nb24 Ne32 O84 Si2 Ti4
• Title of publication: Synthesis, Structural Characterization, and Molecular Modeling of Dodecaniobate Keggin Chain Materials
• Authors of publication: Bonhomme, François; Larentzos, James P.; Alam, Todd M.; Maginn, Edward J.; Nyman, May
• Journal of publication: Inorganic Chemistry
• Year of publication: 2005
• Journal volume: 44
• Journal issue: 6
• Pages of publication: 1774 - 1785
• a: 14.2701 ± 0.0005 Å
• b: 14.2701 ± 0.0005 Å
• c: 11.2923 ± 0.0007 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2299.5 ± 0.2 ų
• Number of distinct elements: 6
• Space group number: 119
• Hermann-Mauguin space group symbol: I -4 m 2
• Hall space group symbol: I -4 -2
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No