Information card for entry 7100168

Structure parameters

• Formula: C72 H72 Ba2 Cl8 Cu2 N12 O46 S4
• Calculated formula: C72 H68 Ba2 Cl8 Cu2 N12 O46 S4
• Title of publication: A Dinuclear Double Helicate with a Reprogrammable Pitch Length.
• Authors of publication: Craig Rice; Christian J. Baylies; J. Jeffery; T. A. Miller; T. Riis-Johanessen
• Journal of publication: Chemical Communications
• Year of publication: 2005
• a: 14.11 ± 0.0003 Å
• b: 19.0281 ± 0.0005 Å
• c: 19.2925 ± 0.0005 Å
• α: 73.495 ± 0.001°
• β: 80.584 ± 0.001°
• γ: 75.378 ± 0.001°
• Cell volume: 4781.9 ± 0.2 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 8
• 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