Information card for entry 2001061

Structure parameters

• Formula: C36 H54 O6
• Calculated formula: C36 H48 O6
• Title of publication: Structure of <i>p</i>-<i>tert</i>-butylhexahomotrioxacalix[3]arene
• Authors of publication: Suzuki, K.; Minami, H.; Yamagata, Y.; Fujii, S.; Tomita, K.; Asfari, Z.; Vicens, J.
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 1992
• Journal volume: 48
• Journal issue: 2
• Pages of publication: 350 - 352
• a: 9.348 ± 0.001 Å
• b: 16.604 ± 0.002 Å
• c: 21.992 ± 0.003 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 3413.5 ± 0.7 ų
• Number of distinct elements: 3
• Space group number: 62
• Hermann-Mauguin space group symbol: P n m a
• Hall space group symbol: -P 2ac 2n
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: Cu
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No