Information card for entry 8000181

Structure parameters

• Formula: C35 H49 Fe N2 O5 P2 Rh
• Calculated formula: C35 H49 Fe N2 O5 P2 Rh
• SMILES: [Rh]1234(N([P]([Fe]5678([P](OC)(OC)N1c1ccccc1)([c]1([c]5([c]6([c]7([c]81C)C)C)C)C)C#[O])(OC)OC)c1ccccc1)[CH]1CC[CH]4=[CH]3CC[CH]2=1
• Title of publication: Synthesis of a Hetero-bimetallic Complex with an Inorganic Cyclic Framework Using a Bis(iminophosphorane)iron Complex as a Chelating Ligand
• Authors of publication: Kubo, Kazuyuki; Akimoto, Takashi; Mizuta, Tsutomu; Miyoshi, Katsuhiko
• Journal of publication: Chemistry Letters
• Year of publication: 2008
• Journal volume: 37
• Journal issue: 2
• Pages of publication: 166
• a: 11.659 ± 0.0003 Å
• b: 15.682 ± 0.0003 Å
• c: 19.626 ± 0.0006 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 3588.35 ± 0.16 ų
• Cell temperature: 200 ± 2 K
• Ambient diffraction temperature: 200 ± 2 K
• Number of distinct elements: 7
• Space group number: 19
• Hermann-Mauguin space group symbol: P 21 21 21
• Hall space group symbol: P 2ac 2ab
• Residual factor for all reflections: 0.0559
• Residual factor for significantly intense reflections: 0.0489
• Weighted residual factors for significantly intense reflections: 0.1013
• Weighted residual factors for all reflections included in the refinement: 0.1053
• Goodness-of-fit parameter for all reflections included in the refinement: 1.072
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No