Information card for entry 2010254

Structure parameters

• Chemical name: Spiro [2,2,3,3-tetrakis (3,5-dimethylpyrazolyl)cyclotriphosphazene - 1-phospha-2,5- diazacyclohexane]
• Formula: C23 H36 N13 P3
• Calculated formula: C23 H36 N13 P3
• Title of publication: 2,2,4,4-Tetrakis(3,5-dimethylpyrazol-1-yl)-2λ^5^,4λ^5^,6λ^5^-cyclotriphosphaza-1,3,5-triene-6-spiro-2'-1',3'-diaza-2'-phosphacyclohexane, C~23~H~36~N~13~P~3~
• Authors of publication: Cordes, A.W.; Folkert, S.; Bryan, C.D.; Chandrasekhar, V.; Thomas, K.R.J.
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 1994
• Journal volume: 50
• Journal issue: 12
• Pages of publication: 1976 - 1978
• a: 31.998 ± 0.008 Å
• b: 10.1595 ± 0.0011 Å
• c: 20.373 ± 0.003 Å
• α: 90°
• β: 111.557 ± 0.017°
• γ: 90°
• Cell volume: 6160 ± 2 ų
• Cell temperature: 293 K
• Ambient diffraction temperature: 293 K
• Number of distinct elements: 4
• 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: 0.135
• Residual factor for significantly intense reflections: 0.052
• Weighted residual factors for all reflections: 0.092
• Weighted residual factors for significantly intense reflections: 0.073
• Goodness-of-fit parameter for significantly intense reflections: 1.15
• Diffraction radiation wavelength: 0.7093 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No