Information card for entry 7230034

Structure parameters

• Formula: C8 H20 Cl5 In N2 O2
• Calculated formula: C8 H20 Cl5 In N2 O2
• Title of publication: Morpholinium chloroindate(iii) complex: a rare acentric structural arrangement leading to piezoelectric properties
• Authors of publication: Owczarek, Magdalena; Szklarz, Przemysław; Moskwa, Marcin; Jakubas, Ryszard
• Journal of publication: CrystEngComm
• Year of publication: 2018
• Journal volume: 20
• Journal issue: 6
• Pages of publication: 703
• a: 32.227 ± 0.009 Å
• b: 14.685 ± 0.006 Å
• c: 14.001 ± 0.006 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 6626 ± 4 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 K
• Number of distinct elements: 6
• Space group number: 36
• Hermann-Mauguin space group symbol: C m c 21
• Hall space group symbol: C 2c -2
• Residual factor for all reflections: 0.0216
• Residual factor for significantly intense reflections: 0.0194
• Weighted residual factors for significantly intense reflections: 0.0426
• Weighted residual factors for all reflections included in the refinement: 0.043
• Goodness-of-fit parameter for all reflections included in the refinement: 0.985
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No