Information card for entry 7100062

Structure parameters

• Common name: t-butyl-calix[4]arene*2(Zn(n-butylamine)3) 2Cl
• Formula: C36 H66.11 Cl1.16 N3.5 O2.5 Zn
• Calculated formula: C36 H66.11 Cl1.16 N3.5 O2.5 Zn
• Title of publication: Extending the chemistry of p-t-butylcalix[4]arene with H-bonding and secondary coordination
• Authors of publication: John Ripmeester; Philip Brown; Gary D. Enright; Konstantin A. Udachin
• Journal of publication: Chemical Communications
• Year of publication: 2005
• a: 12.5854 ± 0.0015 Å
• b: 16.2134 ± 0.0019 Å
• c: 20.695 ± 0.002 Å
• α: 77.408 ± 0.002°
• β: 86.846 ± 0.002°
• γ: 79.32 ± 0.002°
• Cell volume: 4049.5 ± 0.8 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No