Information card for entry 7205281

Structure parameters

• Formula: C48 H50 F6 N8 O20 Si
• Calculated formula: C48 H50 F6 N8 O20 Si
• Title of publication: A subtle interplay of C‒H hydrogen bonds in complexation of anions of varied dimensionality by a nitro functionalized tripodal podand
• Authors of publication: Dey, Sandeep Kumar; Ojha, Bimlesh; Das, Gopal
• Journal of publication: CrystEngComm
• Year of publication: 2011
• Journal volume: 13
• Journal issue: 1
• Pages of publication: 269
• a: 15.4544 ± 0.0009 Å
• b: 17.932 ± 0.0009 Å
• c: 18.607 ± 0.001 Å
• α: 116.352 ± 0.003°
• β: 94.269 ± 0.005°
• γ: 106.342 ± 0.003°
• Cell volume: 4313.2 ± 0.5 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1594
• Residual factor for significantly intense reflections: 0.0935
• Weighted residual factors for significantly intense reflections: 0.2127
• Weighted residual factors for all reflections included in the refinement: 0.244
• Goodness-of-fit parameter for all reflections included in the refinement: 1.161
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No