Information card for entry 7235953

Structure parameters

• Formula: C88 H108 B4 F8 N8 O8 S4
• Calculated formula: C88 H108 B4 F8 N8 O8 S4
• Title of publication: Labile dioxy-functionalised zwitterionic imidazolinium salt: access to zwitterionic and neutral imidazolidin-2-ylidene derivatives and π-acceptor properties of imidazolidine-2-selones
• Authors of publication: Gupta, Vivek; Karthik, Vedhagiri; Anantharaman, Ganapathi
• Journal of publication: RSC Advances
• Year of publication: 2015
• Journal volume: 5
• Journal issue: 107
• Pages of publication: 87888
• a: 11.9074 ± 0.0006 Å
• b: 12.1853 ± 0.0006 Å
• c: 17.801 ± 0.0009 Å
• α: 93.32 ± 0.002°
• β: 103.831 ± 0.002°
• γ: 103.498 ± 0.002°
• Cell volume: 2420.9 ± 0.2 ų
• Cell temperature: 273 ± 2 K
• Ambient diffraction temperature: 273 ± 2 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1478
• Residual factor for significantly intense reflections: 0.0751
• Weighted residual factors for significantly intense reflections: 0.1772
• Weighted residual factors for all reflections included in the refinement: 0.1993
• Goodness-of-fit parameter for all reflections included in the refinement: 0.96
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No