Information card for entry 7233948

Structure parameters

• Formula: C34 H30 B1.5 F6 S8
• Calculated formula: C34 H30 B1.5 F6 S8
• Title of publication: Mixed valence radical cations and intermolecular complexes derived from indenofluorene-extended tetrathiafulvalenes
• Authors of publication: Mikkel A. Christensen; Christian R. Parker; Thomas Just Sorensen; Sebastian de Graaf; Thorbjorn J. Morsing; Theis Brock-Nannestad; Jesper Bendix; Michael M. Haley; Peter Rapta; Andrey Danilov; Sergey Kubatkin; Ole Hammerich; Mogens Brondsted Nielsen
• Journal of publication: Journal of Materials Chemistry C
• Year of publication: 2014
• Journal volume: 2
• Pages of publication: 10428 - 10438
• a: 7.3803 ± 0.0008 Å
• b: 15.8329 ± 0.0015 Å
• c: 16.5567 ± 0.0015 Å
• α: 115.025 ± 0.003°
• β: 92.031 ± 0.004°
• γ: 96.727 ± 0.004°
• Cell volume: 1733.2 ± 0.3 ų
• Cell temperature: 122 ± 2 K
• Ambient diffraction temperature: 122 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1418
• Residual factor for significantly intense reflections: 0.0804
• Weighted residual factors for significantly intense reflections: 0.198
• Weighted residual factors for all reflections included in the refinement: 0.2365
• Goodness-of-fit parameter for all reflections included in the refinement: 1.0575
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No