Information card for entry 7702309

Structure parameters

• Formula: C26 H35 Mo N5 O7 P4
• Calculated formula: C26 Mo N5 O7 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: 17.356 ± 0.003 Å
• b: 12.179 ± 0.003 Å
• c: 17.301 ± 0.003 Å
• α: 90°
• β: 111.969 ± 0.013°
• γ: 90°
• Cell volume: 3391.5 ± 1.2 ų
• Cell temperature: 158 ± 2 K
• Ambient diffraction temperature: 158 ± 2 K
• Number of distinct elements: 6
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.099
• Residual factor for significantly intense reflections: 0.0708
• Weighted residual factors for all reflections: 0.1968
• Weighted residual factors for significantly intense reflections: 0.1785
• Goodness-of-fit parameter for all reflections: 0.994
• Goodness-of-fit parameter for significantly intense reflections: 1.076
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKa
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No