Information card for entry 7236242

Structure parameters

• Formula: C41 H58 Ca N3 O P Se Si2
• Calculated formula: C41 H58 Ca N3 O P Se Si2
• Title of publication: Calcium complexes with imino-phosphinanilido chalcogenide ligands for heterofunctionalisation catalysis
• Authors of publication: Anga, Srinivas; Carpentier, Jean-François; Panda, Tarun K.; Roisnel, Thierry; Sarazin, Yann
• Journal of publication: RSC Advances
• Year of publication: 2016
• Journal volume: 6
• Journal issue: 63
• Pages of publication: 57835
• a: 10.204 ± 0.004 Å
• b: 16.193 ± 0.007 Å
• c: 17.708 ± 0.007 Å
• α: 65.515 ± 0.014°
• β: 85.943 ± 0.012°
• γ: 73.318 ± 0.014°
• Cell volume: 2546.8 ± 1.8 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 8
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1289
• Residual factor for significantly intense reflections: 0.0879
• Weighted residual factors for significantly intense reflections: 0.2587
• Weighted residual factors for all reflections included in the refinement: 0.2821
• Goodness-of-fit parameter for all reflections included in the refinement: 1.148
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No