Information card for entry 4100522

Structure parameters

• Formula: C82 H100.5 Fe4 N2.5 O P S14
• Calculated formula: C82 H99 Fe4 N2.5 O P S14
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2005
• a: 12.847 ± 0.003 Å
• b: 13.073 ± 0.003 Å
• c: 29.484 ± 0.006 Å
• α: 87.695 ± 0.004°
• β: 83.999 ± 0.004°
• γ: 62.947 ± 0.004°
• Cell volume: 4385.6 ± 1.6 ų
• Cell temperature: 193 ± 2 K
• Ambient diffraction temperature: 193 ± 2 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No