Information card for entry 7209059

Structure parameters

• Formula: C112 H132 Br4 Cu4 F12 N32 O26 Si2
• Calculated formula: C112 H112 Br4 Cu4 F12 N32 O26 Si2
• Title of publication: Anions as additive and template in tuning metallasupramolecular architecture in CuII coordination compounds derived from l-amino acid based chiral ligands
• Authors of publication: Banerjee, Subhabrata; Adrash, N. N.; Dastidar, Parthasarathi
• Journal of publication: CrystEngComm
• Year of publication: 2013
• Journal volume: 15
• Journal issue: 2
• Pages of publication: 245
• a: 14.1357 ± 0.0007 Å
• b: 14.1357 ± 0.0007 Å
• c: 17.7983 ± 0.0017 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 3556.4 ± 0.4 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 8
• Space group number: 79
• Hermann-Mauguin space group symbol: I 4
• Hall space group symbol: I 4
• Residual factor for all reflections: 0.078
• Residual factor for significantly intense reflections: 0.0664
• Weighted residual factors for significantly intense reflections: 0.1935
• Weighted residual factors for all reflections included in the refinement: 0.2046
• Goodness-of-fit parameter for all reflections included in the refinement: 0.97
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No