Information card for entry 1554137

Structure parameters

• Formula: C26 H18 N4
• Calculated formula: C26 H18 N4
• SMILES: c1c2cccc3ccc4cccc(c1)c4c23.CC1C(=NC#N)C=C(C)C(=NC#N)C=1
• Title of publication: Ambipolar Transistor Properties of Charge-Transfer Complexes Containing Perylene and Dicyanoquinonediimines
• Authors of publication: Sanada, Ryo; Yoo, Dongho; Sato, Ryonosuke; Iijima, Kodai; Kawamoto, Tadashi; Mori, Takehiko
• Journal of publication: The Journal of Physical Chemistry C
• Year of publication: 2019
• Journal volume: 123
• Journal issue: 19
• Pages of publication: 12088
• a: 7.3012 ± 0.0018 Å
• b: 8.0874 ± 0.0012 Å
• c: 8.7726 ± 0.0017 Å
• α: 72.526 ± 0.013°
• β: 87.384 ± 0.018°
• γ: 89.741 ± 0.016°
• Cell volume: 493.56 ± 0.17 ų
• Cell temperature: 299 K
• Ambient diffraction temperature: 299 K
• Number of distinct elements: 3
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for significantly intense reflections: 0.0555
• Weighted residual factors for all reflections included in the refinement: 0.1627
• Goodness-of-fit parameter for all reflections included in the refinement: 1.039
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Duplicate of: 1554133
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No