Information card for entry 1542471

Structure parameters

• Chemical name: 3,3'-[(Cyclohexane-1,4-diyl)bis(azanediyl)]bis(cyclohex-2-en-1-one)
• Formula: C18 H26 N2 O2
• Calculated formula: C18 H26 N2 O2
• Title of publication: 3,3'-[(Cyclohexane-1,4-diyl)bis(azanediyl)]bis(cyclohex-2-en-1-one)
• Authors of publication: Abdelhamida, Antar A.; Mohamed, Shaaban K.; Simpson, Jim
• Journal of publication: IUCrData
• Year of publication: 2016
• Journal volume: 1
• Journal issue: 1
• Pages of publication: x152175
• a: 8.1839 ± 0.0002 Å
• b: 9.1461 ± 0.0003 Å
• c: 11.7669 ± 0.0004 Å
• α: 106.557 ± 0.003°
• β: 97.687 ± 0.002°
• γ: 96.63 ± 0.002°
• Cell volume: 825.65 ± 0.05 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 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: 0.0423
• Residual factor for significantly intense reflections: 0.0391
• Weighted residual factors for significantly intense reflections: 0.0995
• Weighted residual factors for all reflections included in the refinement: 0.1033
• Goodness-of-fit parameter for all reflections included in the refinement: 1.098
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes