Information card for entry 4350639

Structure parameters

• Formula: C93 H56 Cl2 N8 O4 Rh4
• Calculated formula: C93 H56 Cl2 N8 O4 Rh4
• SMILES: c1c2[c]34c5C(=c6ccc7C(=c8ccc9=C(c%10ccc(=C2c2ccccc2)[n]%10[Rh]23([n]67)(n89)[Rh]364([c]47c8cn([Rh](n15)(C#[O])C#[O])c4C(=c1ccc4C(=c5ccc9=C(c%10ccc(=C8c8ccccc8)[n]%10[Rh]37([n]14)(n59)C6=O)c1ccccc1)c1ccccc1)c1ccccc1)C2=O)c1ccccc1)c1ccccc1)c1ccccc1.C(Cl)Cl
• Title of publication: Unprecedented formation of a rhodium cluster triggered by rhodium-fastened N-confused gable porphyrin.
• Authors of publication: Toganoh, Motoki; Niino, Teppei; Maeda, Hiromitsu; Andrioletti, Bruno; Furuta, Hiroyuki
• Journal of publication: Inorganic chemistry
• Year of publication: 2006
• Journal volume: 45
• Journal issue: 26
• Pages of publication: 10428 - 10430
• a: 14.374 ± 0.006 Å
• b: 24.425 ± 0.01 Å
• c: 22.097 ± 0.01 Å
• α: 90°
• β: 102.66 ± 0.04°
• γ: 90°
• Cell volume: 7569 ± 6 ų
• Cell temperature: 123 ± 2 K
• Ambient diffraction temperature: 123 ± 2 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0681
• Residual factor for significantly intense reflections: 0.054
• Weighted residual factors for significantly intense reflections: 0.1376
• Weighted residual factors for all reflections included in the refinement: 0.1462
• Goodness-of-fit parameter for all reflections included in the refinement: 1.035
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No