Information card for entry 7710161

Structure parameters

• Formula: C6 H16 Ag2 Br4 N2
• Calculated formula: C6 H16 Ag2 Br4 N2
• Title of publication: Templating Effect of Trans-2,5-dimethylpiperazine (TDMP) on the Structure Dimensionality of Hybrid Metal Halides
• Authors of publication: Gautier, Romain; PARIS, Michael; Massuyeau, Florian
• Journal of publication: Dalton Transactions
• Year of publication: 2022
• a: 7.9147 ± 0.0016 Å
• b: 8.0914 ± 0.0016 Å
• c: 12.984 ± 0.004 Å
• α: 90°
• β: 118.58 ± 0.02°
• γ: 90°
• Cell volume: 730.2 ± 0.3 ų
• Cell temperature: 293 K
• Ambient diffraction temperature: 293 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: 0.0336
• Residual factor for significantly intense reflections: 0.0252
• Weighted residual factors for significantly intense reflections: 0.0498
• Weighted residual factors for all reflections included in the refinement: 0.0533
• Goodness-of-fit parameter for all reflections included in the refinement: 1.074
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No