Information card for entry 2001910

Structure parameters

• Formula: C51 H48 N O8 P S
• Calculated formula: C51 H44 N O8 P S
• Title of publication: (+)-2,2'-(1,1'-Binaphthyl)phosphate salt of methyl (11<i>R</i>)-11-{[2-(4-benzylpiperidino)ethyl]thio}-6,11-dihydrodibenz[<i>b</i>,<i>e</i>]oxepin-2-carboxylate
• Authors of publication: Hirayama, N.; Sugaya, T.; Tomioka, S.; Ohshima, E.; Obase, H.
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 1993
• Journal volume: 49
• Journal issue: 3
• Pages of publication: 600 - 602
• a: 16.465 ± 0.002 Å
• b: 30.163 ± 0.003 Å
• c: 9.061 ± 0.001 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 4500 ± 0.9 ų
• Cell temperature: 293 K
• Number of distinct elements: 6
• Hermann-Mauguin space group symbol: P 21 21 21
• Hall space group symbol: P 2ac 2ab
• Residual factor for significantly intense reflections: 0.06
• Weighted residual factors for significantly intense reflections: 0.085
• Goodness-of-fit parameter for significantly intense reflections: 2.4
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No