Information card for entry 7115119

Structure parameters

• Formula: C15 H27 P3 Se4
• Calculated formula: C15 H27 P3 Se4
• SMILES: [Se]1[Se]P2C3([Se]P4C2(C(C)(C)C)[Se]C4(P13)C(C)(C)C)C(C)(C)C
• Title of publication: Syntheses of the novel cage compounds P3Se3C3But3 and P3Se4C3But3 and an unusual insertion reaction of [PtCl2(PMe3)] into the Se‒Se bond of the latter to give the six-coordinate Pt(iv) complex [PtCl2(PMe3)P3Se4C3But3]
• Authors of publication: Hitchcock, Peter B.; Nixon, John F.; Sakarya, Nurgün
• Journal of publication: Chemical Communications
• Year of publication: 2000
• Journal issue: 18
• Pages of publication: 1745
• a: 9.902 ± 0.002 Å
• b: 10.34 ± 0.004 Å
• c: 12.76 ± 0.004 Å
• α: 69.17°
• β: 71.11 ± 0.02°
• γ: 61.57°
• Cell volume: 1054.7 ± 0.6 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 4
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0568
• Residual factor for significantly intense reflections: 0.0367
• Weighted residual factors for significantly intense reflections: 0.0758
• Weighted residual factors for all reflections included in the refinement: 0.0868
• Goodness-of-fit parameter for all reflections included in the refinement: 1.044
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No