Information card for entry 7239340

Structure parameters

• Formula: C35 H30 Cl2 O6
• Calculated formula: C35 H30 Cl2 O6
• Title of publication: Self-assembly and ring-opening metathesis polymerization of a bifunctional carbonate‒stilbene macrocycle
• Authors of publication: Xu, Yuewen; Xu, Weiwei L.; Smith, Mark D.; Shimizu, Linda S.
• Journal of publication: RSC Adv.
• Year of publication: 2014
• Journal volume: 4
• Journal issue: 4
• Pages of publication: 1675
• a: 10.9128 ± 0.0008 Å
• b: 11.6446 ± 0.0008 Å
• c: 12.421 ± 0.0009 Å
• α: 97.081 ± 0.001°
• β: 100.513 ± 0.001°
• γ: 98.806 ± 0.001°
• Cell volume: 1514.93 ± 0.19 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 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: 0.0603
• Residual factor for significantly intense reflections: 0.0492
• Weighted residual factors for significantly intense reflections: 0.1362
• Weighted residual factors for all reflections included in the refinement: 0.1449
• Goodness-of-fit parameter for all reflections included in the refinement: 1.065
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No