Information card for entry 4000629

Structure parameters

• Formula: C26 H40 F30 N7 O20 Pr S10
• Calculated formula: C28.21 H40 F30 N7 O20 Pr S10
• SMILES: [Pr]1234(OS(=NS(=O)(=O)C(F)(F)F)(=O)C(F)(F)F)(OS(=NS(=[O]1)(=O)C(F)(F)F)(=O)C(F)(F)F)(OS(=NS(=[O]2)(=O)C(F)(F)F)(=O)C(F)(F)F)(OS(=O)(=NS(C(F)(F)F)(=[O]3)=O)C(F)(F)F)OS(=NS(=[O]4)(=O)C(F)(F)F)(C(F)(F)F)=O.[N+]1(CCCC1)(CCCC)C.[N+]1(CCCC1)(C)CCCC
• Journal of publication: Chemistry of Materials
• Year of publication: 2005
• a: 12.3204 ± 0.0012 Å
• b: 12.4261 ± 0.0014 Å
• c: 22.64 ± 0.002 Å
• α: 94.44 ± 0.009°
• β: 102.632 ± 0.008°
• γ: 105.792 ± 0.008°
• Cell volume: 3219.8 ± 0.6 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 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: Yes
• Has Fobs: No