Information card for entry 4073724

Structure parameters

• Formula: C35 H28 Cr O7
• Calculated formula: C35 H28 Cr O7
• SMILES: [Cr]12345([c]6([cH]1[cH]2[cH]3[cH]4[cH]56)/C=C\c1c(c(c2c(c1)cccc2)c1c(ccc2ccccc12)OCOC)OCOC)(C#[O])(C#[O])C#[O]
• Title of publication: (η6-Arene)tricarbonylchromium and Ferrocene Complexes Linked to Binaphthyl Derivatives
• Authors of publication: Germaneau, Romain; Chavignon, René; Tranchier, Jean-Philippe; Rose-Munch, Françoise; Rose, Eric; Collot, Mayeul; Duhayon, Carine
• Journal of publication: Organometallics
• Year of publication: 2007
• Journal volume: 26
• Journal issue: 25
• Pages of publication: 6139
• a: 22.541 ± 0.005 Å
• b: 10.63 ± 0.004 Å
• c: 26.256 ± 0.01 Å
• α: 90°
• β: 111.75 ± 0.02°
• γ: 90°
• Cell volume: 5843 ± 3 ų
• Cell temperature: 295 K
• Ambient diffraction temperature: 295 K
• Number of distinct elements: 4
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.191
• Residual factor for significantly intense reflections: 0.0744
• Weighted residual factors for all reflections: 0.2208
• Weighted residual factors for significantly intense reflections: 0.0822
• Weighted residual factors for all reflections included in the refinement: 0.0822
• Goodness-of-fit parameter for all reflections included in the refinement: 1.1442
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No