Information card for entry 7058941

Structure parameters

• Common name: bis(1-aminotetrazolyl) bis(trinitroresorcinato)copper(II)
• Chemical name: bis(1-aminotetrazolyl) bis(trinitroresorcinato)copper(II)
• Formula: C14 H10 Cu N16 O16
• Calculated formula: C14 H10 Cu N16 O16
• Title of publication: Synthesis and Comparison of Copper(II) Complexes with various N-Aminotetrazole Ligands Involving Trinitrophenol Anions
• Authors of publication: Stierstorfer, Joerg; Wurzenberger, Maximilian Hans Horst; Lommel, Marcus; Gruhne, Michael S.; Szimhardt, Norbert; Bissinger, Benjamin
• Journal of publication: New Journal of Chemistry
• Year of publication: 2019
• a: 5.8896 ± 0.0003 Å
• b: 19.8705 ± 0.0009 Å
• c: 10.7979 ± 0.0006 Å
• α: 90°
• β: 94.962 ± 0.006°
• γ: 90°
• Cell volume: 1258.93 ± 0.11 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.084
• Residual factor for significantly intense reflections: 0.0537
• Weighted residual factors for significantly intense reflections: 0.1086
• Weighted residual factors for all reflections included in the refinement: 0.122
• Goodness-of-fit parameter for all reflections included in the refinement: 1.103
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No