Information card for entry 1549521

Structure parameters

• Chemical name: Bis(4-methoxybenzylammonium) tetrabromidocadmate(II)
• Formula: C16 H24 Br4 Cd N2 O2
• Calculated formula: C16 H24 Br4 Cd N2 O2
• SMILES: c1(ccc(cc1)OC)C[NH3+].c1(ccc(cc1)C[NH3+])OC.Br[Cd](Br)([Br-])[Br-]
• Title of publication: Bis(4-methoxybenzylammonium) tetrabromidocadmate(II)
• Authors of publication: Umarani, Parthasarathy; Thiruvalluvar, Aravazhi Amalan; Ramachandra Raja, Chidambaram
• Journal of publication: IUCrData
• Year of publication: 2018
• Journal volume: 3
• Journal issue: 6
• a: 16.7564 ± 0.0013 Å
• b: 7.9403 ± 0.0006 Å
• c: 17.9303 ± 0.0013 Å
• α: 90°
• β: 103.777 ± 0.003°
• γ: 90°
• Cell volume: 2317 ± 0.3 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0867
• Residual factor for significantly intense reflections: 0.0524
• Weighted residual factors for significantly intense reflections: 0.1082
• Weighted residual factors for all reflections included in the refinement: 0.1234
• Goodness-of-fit parameter for all reflections included in the refinement: 1.059
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes