Information card for entry 4088545

Structure parameters

• Formula: C21 H32 Br Ge Mn N2 O6
• Calculated formula: C21 H32 Br Ge Mn N2 O6
• SMILES: CC(C)[NH+]=C(c1ccccc1)NC(C)C.C(C)(C)(C)[Ge]([Mn](C#[O])(C#[O])(C#[O])(C#[O])Br)(O)O
• Title of publication: [MnBrL(CO)4] (L = Amidinatogermylene): Reductive Dimerization, Carbonyl Substitution, and Hydrolysis Reactions
• Authors of publication: Cabeza, Javier A.; García-Álvarez, Pablo; Gobetto, Roberto; González-Álvarez, Laura; Nervi, Carlo; Pérez-Carreño, Enrique; Polo, Diego
• Journal of publication: Organometallics
• Year of publication: 2016
• Journal volume: 35
• Journal issue: 11
• Pages of publication: 1761
• a: 10.9752 ± 0.0004 Å
• b: 13.9014 ± 0.0005 Å
• c: 20.2708 ± 0.0005 Å
• α: 95.819 ± 0.003°
• β: 104.436 ± 0.003°
• γ: 112.043 ± 0.004°
• Cell volume: 2709.89 ± 0.19 ų
• Cell temperature: 123 ± 2 K
• Ambient diffraction temperature: 123 ± 2 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0335
• Residual factor for significantly intense reflections: 0.029
• Weighted residual factors for significantly intense reflections: 0.0771
• Weighted residual factors for all reflections included in the refinement: 0.0808
• Goodness-of-fit parameter for all reflections included in the refinement: 1.033
• Diffraction radiation wavelength: 1.5418 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No