Information card for entry 4100309

Structure parameters

• Formula: C52 H40 Co3 N2 O12
• Calculated formula: C52 H40 Co3 N2 O12
• SMILES: c1(ccccc1)C1=[O][Co]234(OC(c5ccccc5)=[O][Co]([n]5ccccc5)([O]=C(c5ccccc5)O2)O1)OC(c1ccccc1)=[O][Co]([n]1ccccc1)([O]=C(c1ccccc1)O3)OC(=[O]4)c1ccccc1
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2005
• a: 10.4764 ± 0.0002 Å
• b: 10.5116 ± 0.0002 Å
• c: 10.9597 ± 0.0002 Å
• α: 85.32 ± 0.001°
• β: 86.288 ± 0.001°
• γ: 88.897 ± 0.001°
• Cell volume: 1200.26 ± 0.04 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• 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