Information card for entry 7102091

Structure parameters

• Formula: C32.4 H97.6 Al24 N9 O107 P18.5 Si5.5
• Calculated formula: C14.4 Al24 N1.8 O101.6 P24
• Title of publication: Co-templating and modelling in the rational synthesis of zeolitic solids.
• Authors of publication: Castro, Maria; Garcia, Raquel; Warrender, Stewart J; Slawin, Alexandra M Z; Wright, Paul A; Cox, Paul A; Fecant, Antoine; Mellot-Draznieks, Caroline; Bats, Nicolas
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2007
• Journal issue: 33
• Pages of publication: 3470 - 3472
• a: 18.656 ± 0.015 Å
• b: 18.656 ± 0.015 Å
• c: 9.378 ± 0.007 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 3264 ± 4 ų
• Cell temperature: 93 ± 2 K
• Ambient diffraction temperature: 93 ± 2 K
• Number of distinct elements: 7
• Space group number: 85
• Hermann-Mauguin space group symbol: P 4/n :2
• Hall space group symbol: -P 4a
• Residual factor for all reflections: 0.1581
• Residual factor for significantly intense reflections: 0.1027
• Weighted residual factors for significantly intense reflections: 0.194
• Weighted residual factors for all reflections included in the refinement: 0.218
• Goodness-of-fit parameter for all reflections included in the refinement: 1.18
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No