Information card for entry 4320044

Structure parameters

• Common name: DPA [Ga-OH-Ru-CO]
• Formula: C80.6 H82.2 Cl3.2 Ga N8 O2 Ru
• Calculated formula: C80.636 H81.28 Cl3.272 Ga N8 O2 Ru
• Title of publication: Preparation, Characterization, and Luminescence Properties of Gallium-Metal Face-to-Face Diporphyrins (M = H2, GaL, Ru(CO)(OH), Co)
• Authors of publication: Pierre D. Harvey; Nathalie Proulx; Geneviève Martin; Marc Drouin; Daniel J. Nurco; Kevin M. Smith; Frédéric Bolze; Claude P. Gros; Roger Guilard
• Journal of publication: Inorganic Chemistry
• Year of publication: 2001
• Journal volume: 40
• Pages of publication: 4134 - 4142
• a: 22.011 ± 0.003 Å
• b: 11.797 ± 0.003 Å
• c: 30.347 ± 0.004 Å
• α: 90°
• β: 110.725 ± 0.012°
• γ: 90°
• Cell volume: 7370 ± 2 ų
• Cell temperature: 193 ± 2 K
• Ambient diffraction temperature: 193 ± 2 K
• Number of distinct elements: 7
• 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: 0.1402
• Residual factor for significantly intense reflections: 0.1022
• Weighted residual factors for significantly intense reflections: 0.2603
• Weighted residual factors for all reflections included in the refinement: 0.2929
• Goodness-of-fit parameter for all reflections included in the refinement: 0.956
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No