Information card for entry 7101060

Structure parameters

• Formula: C12 H25 N4 O12 P3
• Calculated formula: C12 H25 N4 O12 P3
• SMILES: P(=O)([O-])(O)O.P(=O)(O)([O-])[O-].P(=O)(O)([O-])O.[NH3+]c1cc([NH3+])ccc1.[NH3+]c1cc([NH3+])ccc1
• Title of publication: Unusual variations in the incidence of Z'>1 in oxo-anion structures
• Authors of publication: Jonathan Steed; Kirsty Anderson; Andres E. Goeta; Kirsty S. B. Hancock
• Journal of publication: Chemical Communications
• Year of publication: 2006
• a: 10.9056 ± 0.0006 Å
• b: 13.251 ± 0.0004 Å
• c: 15.7992 ± 0.0008 Å
• α: 113.296 ± 0.003°
• β: 99.154 ± 0.003°
• γ: 95.774 ± 0.003°
• Cell volume: 2036.36 ± 0.16 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 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