Information card for entry 7037198

Structure parameters

• Common name: tetramethylammonium bis-rhodium decaniobate
• Formula: C32 H136 N8 Nb10 O52 Rh2
• Calculated formula: C32 H136 N8 Nb10 O52 Rh2
• SMILES: C[N+](C)(C)C.C[N+](C)(C)C.C[N+](C)(C)C.[N+](C)(C)(C)C.O=[Nb]1234O[Nb]567([O]89%103[Nb]3%11(O2)(O[Nb]9(O1)(O6)(=O)[OH][Rh]12%10([OH]3)[O]3[Nb]69%10(O[Nb]%12%13%14(=O)O[Nb]%15%163([O]3%176%14[Nb]6(O%12)(O%15)(=O)O[Nb]3(O%13)(O9)(=O)[OH][Rh]3%17([O]5[Nb]8(O4)(=O)(O%11)[O]2%163)([O]71%10)[OH]6)=O)=O)=O)=O.O.O.O.O.O.O.O.O.O.C[N+](C)(C)C.C[N+](C)(C)C.C[N+](C)(C)C.[N+](C)(C)(C)C.O.O.O.O.O.O.O.O.O
• Title of publication: Two Rh(III)-substituted polyoxoniobates and their base-induced transformation: [H2RhNb9O28](6-) and [Rh2(OH)4Nb10O30](8.).
• Authors of publication: Son, Jung-Ho; Casey, Willam H.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2015
• Journal volume: 44
• Journal issue: 47
• Pages of publication: 20330 - 20333
• a: 11.0911 ± 0.0015 Å
• b: 15.379 ± 0.002 Å
• c: 24.327 ± 0.003 Å
• α: 90°
• β: 93.748 ± 0.002°
• γ: 90°
• Cell volume: 4140.6 ± 0.9 ų
• Cell temperature: 93 ± 2 K
• Ambient diffraction temperature: 93 ± 2 K
• Number of distinct elements: 6
• 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: 0.0203
• Residual factor for significantly intense reflections: 0.019
• Weighted residual factors for significantly intense reflections: 0.0454
• Weighted residual factors for all reflections included in the refinement: 0.046
• Goodness-of-fit parameter for all reflections included in the refinement: 1.095
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No