Information card for entry 7100094

Structure parameters

• Formula: C75 H102 N12 P6
• Calculated formula: C75 H102 N12 P6
• Title of publication: Synthesis and Structure of the Calixarene-like > Phosph(III)azane Macrocycle [{P(mu-NtBu)}2{1,5-(NH)2C10H6}]3
• Authors of publication: D. S. Wright; Fay Dodds; Felipe Garcia; Richard A. Kowenicki; M. McPartlin; A. Steiner
• Journal of publication: Chemical Communications
• Year of publication: 2005
• a: 16.803 ± 0.003 Å
• b: 16.913 ± 0.003 Å
• c: 17.229 ± 0.003 Å
• α: 61.92 ± 0.03°
• β: 77.82 ± 0.03°
• γ: 64.56 ± 0.03°
• Cell volume: 3900.9 ± 1.4 ų
• Cell temperature: 180 ± 2 K
• Ambient diffraction temperature: 180 ± 2 K
• Number of distinct elements: 4
• 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