Information card for entry 7111006

Structure parameters

• Formula: C45 H46 N4 O11 Ru5
• Calculated formula: C45 H46 N4 O11 Ru5
• Title of publication: Cluster stabilization by an open-chain tetrapyrrolic ligand: first evidence for NH activation as an initial step in tetrapyrrole metalation processes
• Authors of publication: Bröring, Martin; Pfister, Andreas; Ilg, Kerstin
• Journal of publication: Chemical Communications
• Year of publication: 2000
• Journal issue: 15
• Pages of publication: 1407
• a: 19.633 ± 0.004 Å
• b: 15.226 ± 0.003 Å
• c: 17.809 ± 0.004 Å
• α: 90°
• β: 89.76 ± 0.03°
• γ: 90°
• Cell volume: 5323.6 ± 1.9 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 5
• 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: 0.1177
• Residual factor for significantly intense reflections: 0.0542
• Weighted residual factors for significantly intense reflections: 0.1323
• Weighted residual factors for all reflections included in the refinement: 0.1526
• Goodness-of-fit parameter for all reflections included in the refinement: 0.815
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No