Information card for entry 4135460

Structure parameters

• Formula: C20 H24 N2 Na2 O14
• Calculated formula: C20 H24 N2 Na2 O14
• Title of publication: Crystal Lattice Design of H2O-Tolerant n-Type Semiconducting Dianionic Naphthalenediimide Derivatives
• Authors of publication: Abe, Haruka; Kawasaki, Ayumi; Takeda, Takashi; Hoshino, Norihisa; Matsuda, Wakana; Seki, Shu; Akutagawa, Tomoyuki
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2020
• a: 7.53515 ± 0.00014 Å
• b: 9.37159 ± 0.00017 Å
• c: 17.3157 ± 0.0003 Å
• α: 100.624 ± 0.0012°
• β: 98.803 ± 0.0011°
• γ: 93.048 ± 0.0012°
• Cell volume: 1183.48 ± 0.04 ų
• Cell temperature: 100 K
• Ambient diffraction temperature: 100 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: 0.0668
• Residual factor for significantly intense reflections: 0.0496
• Weighted residual factors for significantly intense reflections: 0.1242
• Weighted residual factors for all reflections included in the refinement: 0.136
• Goodness-of-fit parameter for all reflections included in the refinement: 1.112
• Diffraction radiation wavelength: 1.54187 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No