Information card for entry 2013360

Structure parameters

• Chemical name: 4,4'-Bis-(4-iodophenylaminomethyl)-azoxybenzene
• Formula: C26 H22 I2 N4 O
• Calculated formula: C26 H22 I2 N4 O
• Title of publication: 4,4'-Bis(4-iodophenylaminomethyl)azoxybenzene: hydrogen-bonded sheets built from C—H···O and C—H···π(arene) hydrogen bonds
• Authors of publication: Glidewell, Christopher; Low, John N.; Skakle, Janet M. S.; Wardell, James L.
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 2003
• Journal volume: 59
• Journal issue: 4
• Pages of publication: o207 - o209
• a: 5.6959 ± 0.0007 Å
• b: 30.061 ± 0.003 Å
• c: 7.2017 ± 0.0008 Å
• α: 90°
• β: 99.526 ± 0.002°
• γ: 90°
• Cell volume: 1216.1 ± 0.2 ų
• Cell temperature: 291 ± 2 K
• Ambient diffraction temperature: 291 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0909
• Residual factor for significantly intense reflections: 0.065
• Weighted residual factors for significantly intense reflections: 0.1434
• Weighted residual factors for all reflections included in the refinement: 0.1555
• Goodness-of-fit parameter for all reflections included in the refinement: 1.129
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes