Information card for entry 4100318

Structure parameters

• Formula: C44 H103 Cl12 Fe10 N15
• Calculated formula: C44 H103 Cl12 Fe10 N15
• SMILES: [Fe]12([Fe]3456789%10%11%12[Fe]%13%14%15%16([Fe]%17%183([Fe]3%19%20%21%22%23%24%254%13[Fe](Cl)(Cl)([N]%15%17%21)N%24[Fe]%20(Cl)(Cl)[N]4%25[Fe]%1363([Fe]7%194(Cl)([N]%11%18%23)[N]%12%13[Fe]5(Cl)(Cl)N29)(Cl)[N]%10%16%22)(Cl)[N]18%14)Cl)(Cl)Cl.[N+](CC)(CC)(CC)CC.[N+](CC)(CC)(CC)CC.[N+](CC)(CC)(CC)CC.[N+](CC)(CC)(CC)CC.[N+](CC)(CC)(CC)CC.CC#N.N#CC
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2005
• a: 43.523 ± 0.015 Å
• b: 23.303 ± 0.008 Å
• c: 15.201 ± 0.005 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 15417 ± 9 ų
• Cell temperature: 193 ± 2 K
• Ambient diffraction temperature: 193 ± 2 K
• Number of distinct elements: 5
• Space group number: 41
• Hermann-Mauguin space group symbol: A b a 2
• Hall space group symbol: A 2 -2ab
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No