Information card for entry 2014033

Structure parameters

• Chemical name: N,N,N',N'-Tetramethyldiammonium‒succinate‒succinic acid (1/1/1)
• Formula: C14 H28 N2 O8
• Calculated formula: C14 H28 N2 O8
• SMILES: C(=O)(O)CCC(=O)O.C(=O)([O-])CCC(=O)[O-].C([NH+](C)C)C[NH+](C)C
• Title of publication: <i>N</i>,<i>N</i>,<i>N</i>',<i>N</i>'-Tetramethylethylenediammonium‒succinate‒succinic acid (1/1/1)
• Authors of publication: Bruno, Giuseppe; Rotondo, Archimede; De Luca, Lidia; Sammartano, Silvio; Nicoló, Francesco
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 2004
• Journal volume: 60
• Journal issue: 4
• Pages of publication: o287 - o289
• a: 5.637 ± 0.0004 Å
• b: 8.71 ± 0.0008 Å
• c: 8.8431 ± 0.0006 Å
• α: 96.219 ± 0.007°
• β: 93.414 ± 0.006°
• γ: 97.604 ± 0.007°
• Cell volume: 426.63 ± 0.06 ų
• Cell temperature: 298 ± 2 K
• Number of distinct elements: 4
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for significantly intense reflections: 0.0419
• Weighted residual factors for all reflections included in the refinement: 0.1169
• Goodness-of-fit parameter for all reflections included in the refinement: 1.056
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No