Information card for entry 4333930

Structure parameters

• Chemical name: [tetrakis[mu-(trimethylacetato)]bis(6-chloro-2aminopurine-kN3)dirhodium(II)] -dimethylformamide (1/2)"
• Formula: C36 H58 Cl2 N12 O10 Rh2
• Calculated formula: C36 H58 Cl2 N12 O10 Rh2
• Title of publication: Substituent and Noncovalent Interaction Effects in the Reactivity of Purine Derivatives with Tetracarboxylato-dirhodium(II) Units. Rationalization of a Rare Binding Mode via N3
• Authors of publication: Pilar Amo-Ochoa; Óscar Castillo; Ross W. Harrington; Félix Zamora; Andrew Houlton
• Journal of publication: Inorganic Chemistry
• Year of publication: 2013
• Journal volume: 52
• Pages of publication: 2174 - 2181
• a: 8.9815 ± 0.0002 Å
• b: 22.5288 ± 0.0005 Å
• c: 12.4191 ± 0.0003 Å
• α: 90°
• β: 108.848 ± 0.001°
• γ: 90°
• Cell volume: 2378.17 ± 0.1 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 6
• Space group number: 4
• Hermann-Mauguin space group symbol: P 1 21 1
• Hall space group symbol: P 2yb
• Residual factor for all reflections: 0.0594
• Residual factor for significantly intense reflections: 0.0467
• Weighted residual factors for significantly intense reflections: 0.1202
• Weighted residual factors for all reflections included in the refinement: 0.1387
• Goodness-of-fit parameter for all reflections included in the refinement: 1.255
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No