Information card for entry 7035261

Structure parameters

• Formula: C111.5 H140.5 Cu5 Mn5 N10 O48.75 S10.75
• Calculated formula: C111.48 H140.44 Cu5 Mn5 N10 O48.74 S10.74
• Title of publication: A heterobimetallic [MnCu] nanowheel modulated by a flexible bis-oxamate type ligand.
• Authors of publication: do Pim, Walace D.; de Faria, Érica N; Oliveira, Willian X. C.; Pinheiro, Carlos B.; Nunes, Wallace C.; Cano, Joan; Lloret, Francesc; Julve, Miguel; Stumpf, Humberto O.; Pereira, Cynthia L. M.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2015
• Journal volume: 44
• Journal issue: 24
• Pages of publication: 10939 - 10942
• a: 23.2646 ± 0.0019 Å
• b: 31.545 ± 0.002 Å
• c: 23.7317 ± 0.0007 Å
• α: 90°
• β: 102.528 ± 0.005°
• γ: 90°
• Cell volume: 17001.6 ± 1.9 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 7
• 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: 0.1659
• Residual factor for significantly intense reflections: 0.1107
• Weighted residual factors for significantly intense reflections: 0.2962
• Weighted residual factors for all reflections included in the refinement: 0.3482
• Goodness-of-fit parameter for all reflections included in the refinement: 1.174
• Diffraction radiation wavelength: 1.5418 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No