Information card for entry 1517802

Structure parameters

• Formula: C O2
• Calculated formula: C O2
• Title of publication: Structure of Polymeric Carbon Dioxide CO~2~-V
• Authors of publication: Datchi, Frédéric; Mallick, Bidyut; Salamat, Ashkan; Ninet, Sandra
• Journal of publication: Physical Review Letters
• Year of publication: 2012
• Journal volume: 108
• Journal issue: 12
• Pages of publication: 125701
• a: 3.5518 ± 0.0005 Å
• b: 3.5518 ± 0.0005 Å
• c: 5.9184 ± 0.0009 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 74.662 ± 0.019 ų
• Cell temperature: 295 K
• Number of distinct elements: 2
• Space group number: 122
• Hermann-Mauguin space group symbol: I -4 2 d
• Hall space group symbol: I -4 2bw
• Residual factor R(I) for significantly intense reflections: 3.6822
• Method of determination: powder diffraction
• Diffraction radiation type: X-ray
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No