Information card for entry 7008858

Structure parameters

• Common name: [Rh2(hpp)(OAc)3{(OAc)(H2hpp)}2], H2O
• Formula: C31 H57 N9 O11 Rh2
• Calculated formula: C31 H57 N9 O11 Rh2
• SMILES: [Rh]1234([Rh]([N]5=C6N1CCCN6CCC5)([O]=C(O2)C)(OC(=[O]3)C)([O]=C(O4)C)OC(=O)C)OC(=O)C.N1CCCN2C1=[NH+]CCC2.N1CCCN2C1=[NH+]CCC2.O
• Title of publication: A hardwon dirhodium paddlewheel with guanidinate type (hpp) bridging ligands
• Authors of publication: Berry, John F.; Cotton, F. Albert; Huang, Penglin; Murillo, Carlos A.; Wang, Xiaoping
• Journal of publication: Dalton Transactions
• Year of publication: 2005
• Journal issue: 23
• Pages of publication: 3713
• a: 11.272 ± 0.003 Å
• b: 11.4 ± 0.003 Å
• c: 15.856 ± 0.004 Å
• α: 80.768 ± 0.005°
• β: 78.128 ± 0.005°
• γ: 87.688 ± 0.005°
• Cell volume: 1968 ± 0.9 ų
• Cell temperature: 213 ± 2 K
• Ambient diffraction temperature: 213 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0647
• Residual factor for significantly intense reflections: 0.0409
• Weighted residual factors for significantly intense reflections: 0.0936
• Weighted residual factors for all reflections included in the refinement: 0.1055
• Goodness-of-fit parameter for all reflections included in the refinement: 1.034
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No