Information card for entry 4315359

Structure parameters

• Formula: C34 H50 B Cl6 Fe N6 O4
• Calculated formula: C35 H61 B Cl8 Fe N6 O4
• Title of publication: Oxygen Activation at Mononuclear Nonheme Iron Centers: A Superoxo Perspective
• Authors of publication: Anusree Mukherjee; Matthew A. Cranswick; Mrinmoy Chakrabarti; Tapan K. Paine; Kiyoshi Fujisawa; Eckard Münck; Lawrence Que
• Journal of publication: Inorganic Chemistry
• Year of publication: 2010
• Journal volume: 49
• Pages of publication: 3618 - 3628
• a: 12.549 ± 0.003 Å
• b: 13.537 ± 0.003 Å
• c: 13.733 ± 0.003 Å
• α: 88.421 ± 0.003°
• β: 89.132 ± 0.003°
• γ: 80.386 ± 0.003°
• Cell volume: 2299.1 ± 0.9 ų
• 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