Information card for entry 7111612

Structure parameters

• Formula: C7 H7 Cu N2
• Calculated formula: C7 H7 Cu N2
• Title of publication: Reversible luminescent reaction of amines with copper(i) cyanide
• Authors of publication: Ley, Amanda N.; Dunaway, Lars E.; Brewster, Timothy P.; Dembo, Matthew D.; Harris, T. David; Baril-Robert, François; Li, Xiaobo; Patterson, Howard H.; Pike, Robert D.
• Journal of publication: Chemical Communications
• Year of publication: 2010
• Journal volume: 46
• Journal issue: 25
• Pages of publication: 4565 - 4567
• a: 10.0593 ± 0.0002 Å
• b: 8.7276 ± 0.0001 Å
• c: 8.9901 ± 0.0002 Å
• α: 90°
• β: 108.709 ± 0.001°
• γ: 90°
• Cell volume: 747.57 ± 0.02 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 4
• 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: 0.0316
• Residual factor for significantly intense reflections: 0.0276
• Weighted residual factors for significantly intense reflections: 0.0768
• Weighted residual factors for all reflections included in the refinement: 0.0791
• Goodness-of-fit parameter for all reflections included in the refinement: 1.098
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No