Information card for entry 4346452

Structure parameters

• Formula: C80 H60 N8 O16 Re4
• Calculated formula: C80 H60 N8 O16 Re4
• SMILES: c1cc2/C=C/c3cc[n](cc3)[Re]3(C#[O])(C#[O])(N(c4cc5O[Re](C#[O])(N(c5cc4O3)CCc3ccccc3)([n]3ccc(/C=C/c4cc[n]([Re]5(C#[O])(N(c6cc7O[Re]([n]1cc2)(C#[O])(C#[O])(C#[O])N(c7cc6O5)CCc1ccccc1)CCc1ccccc1)(C#[O])C#[O])cc4)cc3)(C#[O])C#[O])CCc1ccccc1)C#[O]
• Title of publication: Synthesis, Structural Characterization, and Host-Guest Studies of Aminoquinonato-Bridged Re(I) Supramolecular Rectangles.
• Authors of publication: Govindarajan, R.; Nagarajaprakash, R.; Manimaran, Bala
• Journal of publication: Inorganic chemistry
• Year of publication: 2015
• Journal volume: 54
• Journal issue: 22
• Pages of publication: 10686 - 10694
• a: 23.0606 ± 0.0016 Å
• b: 22.355 ± 0.002 Å
• c: 12.2692 ± 0.0007 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 6325 ± 0.8 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 5
• Space group number: 34
• Hermann-Mauguin space group symbol: P n n 2
• Hall space group symbol: P 2 -2n
• Residual factor for all reflections: 0.1103
• Residual factor for significantly intense reflections: 0.0722
• Weighted residual factors for significantly intense reflections: 0.1869
• Weighted residual factors for all reflections included in the refinement: 0.2051
• Goodness-of-fit parameter for all reflections included in the refinement: 0.972
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No