Information card for entry 1559659

Structure parameters

• Common name: (R)-(‒)-1,1-Diphenyl-3-piperidiniobutan-1-ol (R,R)-tartrate
• Formula: C25 H33 N O7
• Calculated formula: C25 N O7
• SMILES: OC(c1ccccc1)(C[C@H]([NH+]1CCCCC1)C)c1ccccc1.[O-]C(=O)[C@H](O)[C@@H](O)C(=O)O
• Title of publication: (R)-(‒)-1,1-Diphenyl-3-piperidinobutan-1-ol, an Anticholinergic Agent. The Crystal Structure of (R)-(‒)-1,1-Diphenyl-3-piperidiniobutan-1-ol (R,R)-tartrate
• Authors of publication: Schjelderup, Lise; Groth, Per A.; Aasen, Arne Jorgen
• Journal of publication: Acta Chemica Scandinavica
• Year of publication: 1990
• Journal volume: 44
• Pages of publication: 284 - 287
• a: 5.93 ± 0.001 Å
• b: 10.095 ± 0.002 Å
• c: 10.946 ± 0.002 Å
• α: 70.69 ± 0.02°
• β: 81.62 ± 0.02°
• γ: 89.86 ± 0.02°
• Cell volume: 611.1 ± 0.2 ų
• Ambient diffraction temperature: 296 K
• Number of distinct elements: 4
• Space group number: 1
• Hermann-Mauguin space group symbol: P 1
• Hall space group symbol: P 1
• Residual factor for significantly intense reflections: 0.076
• Weighted residual factors for significantly intense reflections: 0.056
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No