Information card for entry 7033168

Structure parameters

• Formula: C42 H84 In10 N14 Se21
• Calculated formula: C42 H84 In10 N14 Se21
• Title of publication: Structural complexity in indium selenides prepared using bicyclic amines as structure-directing agents.
• Authors of publication: Ewing, S. J.; Vaqueiro, P.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2015
• Journal volume: 44
• Journal issue: 4
• Pages of publication: 1592 - 1600
• a: 35.936 ± 0.003 Å
• b: 21.7994 ± 0.0015 Å
• c: 10.4921 ± 0.0007 Å
• α: 90°
• β: 91.201 ± 0.003°
• γ: 90°
• Cell volume: 8217.5 ± 1 ų
• Cell temperature: 100 K
• Ambient diffraction temperature: 100 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: 0.1222
• Residual factor for significantly intense reflections: 0.0807
• Weighted residual factors for all reflections: 0.0999
• Weighted residual factors for significantly intense reflections: 0.0767
• Weighted residual factors for all reflections included in the refinement: 0.0721
• Goodness-of-fit parameter for all reflections included in the refinement: 1.1126
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No