Information card for entry 2104600

Structure parameters

• Formula: C6 H10 Cl2 N2 O8
• Calculated formula: C6 H10 Cl2 N2 O8
• SMILES: c1c([NH3+])ccc(c1)[NH3+].[O-]Cl(=O)(=O)=O.[O-]Cl(=O)(=O)=O
• Title of publication: Space groups <i>P</i>1 and <i>Cc</i>: how are they doing?
• Authors of publication: Marsh, Richard E.
• Journal of publication: Acta Crystallographica Section B
• Year of publication: 2009
• Journal volume: 65
• Journal issue: 6
• Pages of publication: 782 - 783
• a: 5.097 ± 0.0008 Å
• b: 7.1061 ± 0.0013 Å
• c: 8.7475 ± 0.0012 Å
• α: 103.625 ± 0.009°
• β: 103.274 ± 0.009°
• γ: 108.086 ± 0.009°
• Cell volume: 276.54 ± 0.08 ų
• Cell temperature: 273 ± 2 K
• Ambient diffraction temperature: 273 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No