Information card for entry 1507245

Structure parameters

• Common name: 1,4,5,8-Naphthaldiimide
• Chemical name: 1,4,5,8-Naphthalenetetracarboxylic 1,8:4,5 diimide
• Formula: C14 H6 N2 O4
• Calculated formula: C14 H6 N2 O4
• Title of publication: Assembly and Processing of Hydrogen Bond Induced Supramolecular Nanostructures
• Authors of publication: Keeling, D. L.; Oxtoby, N. S.; Wilson, C.; Humphry, M. J.; Champness, N. R.; Beton, P. H.
• Journal of publication: Nano Letters
• Year of publication: 2003
• Journal volume: 3
• Journal issue: 1
• Pages of publication: 9
• a: 7.6345 ± 0.001 Å
• b: 8.1774 ± 0.0011 Å
• c: 8.9355 ± 0.0012 Å
• α: 89.56 ± 0.002°
• β: 71.295 ± 0.002°
• γ: 80.065 ± 0.002°
• Cell volume: 519.78 ± 0.12 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 4
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0935
• Residual factor for significantly intense reflections: 0.0437
• Weighted residual factors for significantly intense reflections: 0.0843
• Weighted residual factors for all reflections included in the refinement: 0.0983
• Goodness-of-fit parameter for all reflections included in the refinement: 0.874
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No