Information card for entry 7702306

Structure parameters

• Formula: C22 H35 N5 O3 P4
• Calculated formula: C22 H30 N5 O3 P4
• Title of publication: Synthesis, reactivity and structural characterisation of bicyclic tetraphosphapentazanes
• Authors of publication: Thirupathi, Natesan; Krishnamurthy, Setharampattu S.; Nethaji, Munirathinam
• Journal of publication: Journal of the Chemical Society, Dalton Transactions
• Year of publication: 1998
• Journal issue: 9
• Pages of publication: 1469
• a: 8.668 ± 0.002 Å
• b: 34.879 ± 0.007 Å
• c: 9.7837 ± 0.001 Å
• α: 90°
• β: 107.359 ± 0.014°
• γ: 90°
• Cell volume: 2823.2 ± 0.9 ų
• Cell temperature: 290 ± 2 K
• Ambient diffraction temperature: 290 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.1625
• Residual factor for significantly intense reflections: 0.0765
• Weighted residual factors for all reflections: 0.2185
• Weighted residual factors for significantly intense reflections: 0.1616
• Goodness-of-fit parameter for all reflections: 1.105
• Goodness-of-fit parameter for significantly intense reflections: 1.175
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: MoKa
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No