Information card for entry 7224007

Structure parameters

• Common name: JA315b
• Formula: C4 H10 Cu I N2 S2
• Calculated formula: C4 H10 Cu I N2 S2
• Title of publication: Strong luminescent copper(i) halide coordination polymers and dinuclear complexes with thioacetamide and N,N′-donor ligands
• Authors of publication: Troyano, Javier; Perles, Josefina; Amo-Ochoa, Pilar; Zamora, Félix; Delgado, Salomé
• Journal of publication: CrystEngComm
• Year of publication: 2016
• Journal volume: 18
• Journal issue: 10
• Pages of publication: 1809
• a: 7.4292 ± 0.0002 Å
• b: 8.0762 ± 0.0002 Å
• c: 9.614 ± 0.0002 Å
• α: 107.059 ± 0.001°
• β: 90.971 ± 0.001°
• γ: 110.972 ± 0.001°
• Cell volume: 510.1 ± 0.02 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0221
• Residual factor for significantly intense reflections: 0.0199
• Weighted residual factors for significantly intense reflections: 0.0503
• Weighted residual factors for all reflections included in the refinement: 0.0516
• Goodness-of-fit parameter for all reflections included in the refinement: 1.004
• Diffraction radiation wavelength: 0.71073 Å
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No