Information card for entry 7114540

Structure parameters

• Formula: C107 H136.5 N13.5 O16 P4
• Calculated formula: C107 H136.5 N13.5 O16 P4
• Title of publication: Novel reactions of phosphorus(iii) azides and isocyanates: unusual modes of cycloaddition with dipolarophiles and an unexpected case of ring expansionElectronic supplementary information (ESI) available: Platon diagrams with selected bond parameters for 4 and 6 and experimental details. See http://www.rsc.org/suppdata/cc/b1/b107087h/
• Authors of publication: Kumaraswamy, Sudha; Kommana, Praveen; Satish Kumar, N.; Kumara Swamy, K. C.
• Journal of publication: Chemical Communications
• Year of publication: 2002
• Journal issue: 1
• Pages of publication: 40
• a: 14.616 ± 0.004 Å
• b: 19.288 ± 0.004 Å
• c: 23.112 ± 0.008 Å
• α: 114.26 ± 0.02°
• β: 103.91 ± 0.02°
• γ: 96.55 ± 0.02°
• Cell volume: 5597 ± 3 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1464
• Residual factor for significantly intense reflections: 0.0658
• Weighted residual factors for significantly intense reflections: 0.1651
• Weighted residual factors for all reflections included in the refinement: 0.229
• Goodness-of-fit parameter for all reflections included in the refinement: 0.983
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No