Information card for entry 7054079

Structure parameters

• Formula: C26 H22 N4 O2 S7
• Calculated formula: C26 H22 N4 O2 S7
• Title of publication: Terpyridine‒tetrathiafulvalene hybrid ligands and their electroactive metal complexes
• Authors of publication: Belhadj, Esmah; El-Ghayoury, Abdelkrim; Ripaud, Emilie; Zorina, Leokadiya; Allain, Magali; Batail, Patrick; Mazari, Miloud; Sallé, Marc
• Journal of publication: New Journal of Chemistry
• Year of publication: 2013
• Journal volume: 37
• Journal issue: 5
• Pages of publication: 1427
• a: 20.167 ± 0.003 Å
• b: 19.979 ± 0.005 Å
• c: 15.367 ± 0.004 Å
• α: 90°
• β: 113.935 ± 0.013°
• γ: 90°
• Cell volume: 5659 ± 2 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• 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: 0.1545
• Residual factor for significantly intense reflections: 0.0675
• Weighted residual factors for significantly intense reflections: 0.1266
• Weighted residual factors for all reflections included in the refinement: 0.168
• Goodness-of-fit parameter for all reflections included in the refinement: 1.077
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No