Information card for entry 2201803

Structure parameters

• Chemical name: (-)-(P)-N,N'-bis[(5-bromo-2-hydroxyphenyl)methylidene]- 6,6'-dimethyl-1,1'-biphenyl-2,2'-dimethanamine
• Formula: C30 H26 Br2 N2 O2
• Calculated formula: C30 H26 Br2 N2 O2
• SMILES: Brc1ccc(O)c(/C=N/Cc2c(c(ccc2)C)c2c(cccc2C)C/N=C/c2c(O)ccc(Br)c2)c1
• Title of publication: ({-})-(<i>P</i>)-<i>N,N</i>'-Bis[(5-bromo-2-hydroxyphenyl)methylidene]-6,6'-dimethyl-1,1'-biphenyl-2,2'-dimethanamine
• Authors of publication: Linden, Anthony; Rippert, Andreas J.
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2003
• Journal volume: 59
• Journal issue: 4
• Pages of publication: o390 - o392
• a: 17.496 ± 0.005 Å
• b: 18.59 ± 0.002 Å
• c: 8.074 ± 0.007 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2626 ± 2 ų
• Cell temperature: 173 ± 1 K
• Ambient diffraction temperature: 173 ± 1 K
• Number of distinct elements: 5
• Space group number: 19
• Hermann-Mauguin space group symbol: P 21 21 21
• Hall space group symbol: P 2ac 2ab
• Residual factor for all reflections: 0.1414
• Residual factor for significantly intense reflections: 0.0482
• Weighted residual factors for significantly intense reflections: 0.0876
• Weighted residual factors for all reflections included in the refinement: 0.1055
• Goodness-of-fit parameter for all reflections included in the refinement: 0.982
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes