Information card for entry 7150494

Structure parameters

• Chemical name: N,N'-bis(2-pyridyl)-4,4'-methylenebis(aminobenzene) 1,4-benzenedicarboxylic acid ethanol 2:1:2
• Formula: C29 H29 N4 O3
• Calculated formula: C29 H29 N4 O3
• Title of publication: Creation of hydrogen bonded 1D networks by co-crystallization of N,N'-bis(2-pyridyl)aryldiamines with dicarboxylic acidsSupramolecular structures formed by 2-aminopyridine derivatives. Part II.5
• Authors of publication: Bensemann, Igor; Gdaniec, Maria; Łakomecka, Karina; Milewska, Maria J.; Połoński, Tadeusz
• Journal of publication: Organic & Biomolecular Chemistry
• Year of publication: 2003
• Journal volume: 1
• Journal issue: 8
• Pages of publication: 1425
• a: 8.783 ± 0.0011 Å
• b: 10.6035 ± 0.0011 Å
• c: 13.8087 ± 0.0015 Å
• α: 88.06 ± 0.009°
• β: 87.645 ± 0.009°
• γ: 86.861 ± 0.009°
• Cell volume: 1282.4 ± 0.3 ų
• Cell temperature: 294 ± 2 K
• Ambient diffraction temperature: 294 ± 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: 0.1515
• Residual factor for significantly intense reflections: 0.0713
• Weighted residual factors for significantly intense reflections: 0.1562
• Weighted residual factors for all reflections included in the refinement: 0.1934
• Goodness-of-fit parameter for all reflections included in the refinement: 1.085
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No