Information card for entry 7100361

Structure parameters

• Common name: Tetraacqua-hemi-(1,2-bis(4-pyridyl)ethane)-tris-3,5-dinitro-4- methyl benzoato Praseodymium(iii) complex
• Formula: C30 H29 N7 O22 Pr
• Calculated formula: C30 H19 N7 O22 Pr
• Title of publication: Hydrogen Bond Mediated Open-frame Networks in Coordination Polymers: Supramolecular Assemblies of Pr(III) and 3,5-Dinitro-4-methylbenzoic Acid with Aza-donor Compounds
• Authors of publication: V. Pedireddi; Sunil Varughese
• Journal of publication: Chemical Communications
• Year of publication: 2005
• a: 9.517 ± 0.002 Å
• b: 12.747 ± 0.002 Å
• c: 16.366 ± 0.003 Å
• α: 72.21 ± 0.02°
• β: 78.98 ± 0.03°
• γ: 79.84 ± 0.02°
• Cell volume: 1840.8 ± 0.6 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 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