Information card for entry 4073702

Structure parameters

• Formula: C22 H20 Cr Fe O3 Si
• Calculated formula: C22 H20 Cr Fe O3 Si
• SMILES: [Fe]12345678([c]9([Si](C=C)(C)[c]%10%11[Cr]%12%13%14%15([cH]%10[cH]%12[cH]%13[cH]%14[cH]%11%15)(C#[O])(C#[O])C#[O])[cH]1[cH]2[cH]3[cH]49)[cH]1[cH]5[cH]6[cH]7[cH]81
• Title of publication: Multiredox Heterometallic Carbosilane Dendrimers
• Authors of publication: Zamora, Magdalena; Alonso, Beatriz; Pastor, César; Cuadrado, Isabel
• Journal of publication: Organometallics
• Year of publication: 2007
• Journal volume: 26
• Journal issue: 21
• Pages of publication: 5153
• a: 10.4463 ± 0.0002 Å
• b: 11.9294 ± 0.0002 Å
• c: 16.3013 ± 0.0003 Å
• α: 90°
• β: 97.001 ± 0.001°
• γ: 90°
• Cell volume: 2016.29 ± 0.06 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 6
• 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: 0.0577
• Residual factor for significantly intense reflections: 0.0412
• Weighted residual factors for significantly intense reflections: 0.1027
• Weighted residual factors for all reflections included in the refinement: 0.111
• Goodness-of-fit parameter for all reflections included in the refinement: 1.019
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No