Information card for entry 7110882

Structure parameters

• Formula: C6 H6 Cu I N2 O
• Calculated formula: C6 H6 Cu I N2 O
• Title of publication: Deliberate combination of coordination polymers and hydrogen bonds in a supramolecular design strategy for inorganic/organic hybrid networks
• Authors of publication: Aakeröy, Christer B.; Beatty, Alicia M.; Leinen, Destin S.; Lorimer, Keith R.
• Journal of publication: Chemical Communications
• Year of publication: 2000
• Journal issue: 11
• Pages of publication: 935
• a: 13.495 ± 0.003 Å
• b: 4.1059 ± 0.0009 Å
• c: 16.727 ± 0.004 Å
• α: 90°
• β: 109.626 ± 0.004°
• γ: 90°
• Cell volume: 873 ± 0.3 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• 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: 0.0687
• Residual factor for significantly intense reflections: 0.0514
• Weighted residual factors for significantly intense reflections: 0.1334
• Weighted residual factors for all reflections included in the refinement: 0.1441
• Goodness-of-fit parameter for all reflections included in the refinement: 1.109
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No