Information card for entry 1101089

Structure parameters

• Formula: C12 H12 Cl2 N8 O V
• Calculated formula: C12 H12 Cl2 N8 O V
• SMILES: [V]12(Cl)(=O)([n]3cc[nH]c3c3[nH]cc[n]13)[n]1cc[nH]c1c1[nH]cc[n]21.[Cl-]
• Authors of publication: Juan Cancela; María J. González Garmendia; Miguel Quirós
• Journal of publication: Inorganica Chimica Acta
• Year of publication: 2001
• Journal volume: 313
• Pages of publication: 156 - 159
• a: 11.4188 ± 0.0011 Å
• b: 10.5354 ± 0.0012 Å
• c: 14.2058 ± 0.0013 Å
• α: 90°
• β: 97.179 ± 0.008°
• γ: 90°
• Cell volume: 1695.6 ± 0.3 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No