Information card for entry 2016864

Structure parameters

• Common name: <i>cyclo</i>-bis{5-(oxymethyl)-4-{(<i>E</i>)-[(2-oxyphenyl)imino]methyl}- 2-methylpyridin-3-ol}diphenylsilane} chloroform tetrasolvate
• Chemical name: 9,27-dimethyl-3,3,21,21-tetraphenyl-2,4,20,22-tetraoxa-8,13,26,31-tetraaza- 3,21-disilapentacyclo[30.4.0.0^6,11^.0^14,19^.0^24,29^]hexatrideca- 1(32),6,8,10,12,14,16,18,24,26,28,30,33,35-tetradecaene-10,28-diol chloroform tetrasolvate
• Formula: C56 H48 Cl12 N4 O6 Si2
• Calculated formula: C56 H48 Cl12 N4 O6 Si2
• Title of publication: Formation of a silicon-containing macrocycle with a pyridoxalimine Schiff base ligand
• Authors of publication: Böhme, Uwe; Günther, Betty; Schwarzer, Anke
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 2008
• Journal volume: 64
• Journal issue: 12
• Pages of publication: o630 - o632
• a: 9.8831 ± 0.0003 Å
• b: 11.2094 ± 0.0003 Å
• c: 14.7584 ± 0.0004 Å
• α: 102.853 ± 0.002°
• β: 101.899 ± 0.001°
• γ: 98.733 ± 0.001°
• Cell volume: 1525.91 ± 0.08 ų
• Cell temperature: 153 ± 2 K
• Ambient diffraction temperature: 153 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0581
• Residual factor for significantly intense reflections: 0.043
• Weighted residual factors for significantly intense reflections: 0.1068
• Weighted residual factors for all reflections included in the refinement: 0.1139
• Goodness-of-fit parameter for all reflections included in the refinement: 1.07
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: Yes