Information card for entry 2003787

Structure parameters

• Chemical name: 2,6-DIMETHYLPHENYL(CARBOXYMETHYL)GLYCINATOCOPPER(II)MONOAQUOMONOAMMIN.
• Formula: C12 H18 Cu N2 O5
• Calculated formula: C12 H18 Cu N2 O5
• Title of publication: (Ammine)(aqua)[<i>N</i>-(2,6-dimethylphenyl)-<i>N</i>-(carboxymethyl)glycinato-<i>N</i>,<i>O</i>,<i>O</i>'']copper(II)
• Authors of publication: Hidalgo, M. A.; Romerosa, A.; Suárez-Varela, J.; Avila-Rosón, J. C.; Martín-Ramos, J. D.
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 1995
• Journal volume: 51
• Journal issue: 8
• Pages of publication: 1510 - 1512
• a: 12.384 ± 0.002 Å
• b: 7.684 ± 0.002 Å
• c: 15.739 ± 0.003 Å
• α: 90°
• β: 111.65 ± 0.03°
• γ: 90°
• Cell volume: 1392 ± 0.6 ų
• Cell temperature: 294 K
• Ambient diffraction temperature: 294 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.2751
• Residual factor for significantly intense reflections: 0.0387
• Weighted residual factors for all reflections: 0.2601
• Weighted residual factors for significantly intense reflections: 0.0459
• Goodness-of-fit parameter for significantly intense reflections: 1.9165
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No