Information card for entry 4329928

Structure parameters

• Formula: C45 H29 F18 N2 Ni O8 S6 Y
• Calculated formula: C45 H29 F18 N2 Ni O8 S6 Y
• Title of publication: 3d4f Heterobimetallic Dinuclear and Tetranuclear Complexes Involving Tetrathiafulvalene as Ligands: X-ray Structures and Magnetic and Photophysical Investigations
• Authors of publication: Goulven Cosquer; Fabrice Pointillart; Boris Le Guennic; Yann Le Gal; Stéphane Golhen; Olivier Cador; Lahcène Ouahab
• Journal of publication: Inorganic Chemistry
• Year of publication: 2012
• Journal volume: 51
• Pages of publication: 8488 - 8501
• a: 13.2766 ± 0.0006 Å
• b: 13.3127 ± 0.001 Å
• c: 16.5097 ± 0.0013 Å
• α: 85.513 ± 0.003°
• β: 77.716 ± 0.004°
• γ: 84.331 ± 0.004°
• Cell volume: 2832.4 ± 0.3 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 8
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1119
• Residual factor for significantly intense reflections: 0.0517
• Weighted residual factors for significantly intense reflections: 0.1149
• Weighted residual factors for all reflections included in the refinement: 0.1443
• Goodness-of-fit parameter for all reflections included in the refinement: 0.998
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No