Information card for entry 7033270

Structure parameters

• Formula: C20 H70 K4 Nb6 O39 Rh2
• Calculated formula: C20 H30 K4 Nb6 O39 Rh2
• SMILES: [K+].O.[K+].O.O=[Nb]1234[O]5[Rh]6789%10([c]%11([c]7([c]8([c]9([c]6%11C)C)C)C)C)[O]1[Nb]167([O]89%113[Nb]35(O[Nb]58(O2)(=O)[O]2[Nb]9(=O)([O]8[Nb]%11(=O)([O]5[Rh]59%11%1228[c]2([c]5([c]9([c]%12([c]%112C)C)C)C)C)(O7)O3)(O6)O4)(=O)[O]1%10)=O.O.O.O.O.O.O.O.O.[K+].O.[K+].O.O.O.O.O.O.O.O.O
• Title of publication: Grafting {Cp*Rh}(2+) on the surface of Nb and Ta Lindqvist-type POM.
• Authors of publication: Abramov, P. A.; Sokolov, M. N.; Virovets, A. V.; Floquet, S.; Haouas, M.; Taulelle, F.; Cadot, E.; Vicent, C.; Fedin, V. P.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2015
• Journal volume: 44
• Journal issue: 5
• Pages of publication: 2234 - 2239
• a: 14.8711 ± 0.0017 Å
• b: 9.5972 ± 0.0011 Å
• c: 19.615 ± 0.002 Å
• α: 90°
• β: 91.761 ± 0.003°
• γ: 90°
• Cell volume: 2798.1 ± 0.5 ų
• Cell temperature: 150 ± 0.2 K
• Ambient diffraction temperature: 150 ± 0.2 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: 0.0994
• Residual factor for significantly intense reflections: 0.0659
• Weighted residual factors for significantly intense reflections: 0.1302
• Weighted residual factors for all reflections included in the refinement: 0.1425
• Goodness-of-fit parameter for all reflections included in the refinement: 1.097
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No