Information card for entry 4321566

Structure parameters

• Formula: C8 H18 N2 Se2
• Calculated formula: C8 H18 N2 Se2
• SMILES: C(C)(C)(C)N1[Se]N(C(C)(C)C)[Se]N(C(C)(C)C)[Se]1
• Title of publication: Selenium Imides: 77Se NMR Investigations of the SeCl2-tBuNH2 Reaction and X-ray Structures of Se3(NtBu)3, tBuNSe(μ-NtBu)2SO2, and tBuNSe(μ-NtBu)2SeO
• Authors of publication: Tiina Maaninen; Tristram Chivers; Risto Laitinen; Gabriele Schatte; Maija Nissinen
• Journal of publication: Inorganic Chemistry
• Year of publication: 2000
• Journal volume: 39
• Pages of publication: 5341 - 5347
• a: 9.866 ± 0.0003 Å
• b: 9.866 ± 0.0003 Å
• c: 20.8427 ± 0.0007 Å
• α: 90°
• β: 90°
• γ: 120°
• Cell volume: 1756.98 ± 0.1 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 4
• Space group number: 165
• Hermann-Mauguin space group symbol: P -3 c 1
• Hall space group symbol: -P 3 2"c
• Residual factor for all reflections: 0.0452
• Residual factor for significantly intense reflections: 0.0381
• Weighted residual factors for significantly intense reflections: 0.0899
• Weighted residual factors for all reflections included in the refinement: 0.103
• Goodness-of-fit parameter for all reflections included in the refinement: 0.322
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No