Information card for entry 7110884

Structure parameters

• Formula: C8 H18 Cl2 N2 Se3
• Calculated formula: C8 H18 Cl2 N2 Se3
• SMILES: C(C)(C)(C)N([Se]Cl)[Se]N(C(C)(C)C)[Se]Cl
• Title of publication: Acyclic imidoselenium(ii) dihalides: synthesis and X-ray structures of ClSe[N(But)Se]nCl (n = 1, 2)
• Authors of publication: Maaninen, Tiina; Chivers, Tristram; Laitinen, Risto; Wegelius, Elina
• Journal of publication: Chemical Communications
• Year of publication: 2000
• Journal issue: 9
• Pages of publication: 759
• a: 9.989 ± 0.002 Å
• b: 9.643 ± 0.002 Å
• c: 16.124 ± 0.003 Å
• α: 90°
• β: 101.81 ± 0.03°
• γ: 90°
• Cell volume: 1520.2 ± 0.5 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 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: 0.0371
• Residual factor for significantly intense reflections: 0.0262
• Weighted residual factors for significantly intense reflections: 0.0792
• Weighted residual factors for all reflections included in the refinement: 0.091
• Goodness-of-fit parameter for all reflections included in the refinement: 0.692
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No