Information card for entry 7121602

Structure parameters

• Chemical name: AKY-623
• Formula: C27 H21 Mo O6 P
• Calculated formula: C27 H21 Mo O6 P
• Title of publication: "Low-coordinate" 1,2-oxaphosphetanes - a new opportunity in coordination and main group chemistry.
• Authors of publication: Kyri, A. W.; Gleim, F.; García Alcaraz, A; Schnakenburg, G.; Espinosa Ferao, A.; Streubel, R.
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2018
• Journal volume: 54
• Journal issue: 52
• Pages of publication: 7123 - 7126
• a: 9.6734 ± 0.0004 Å
• b: 10.6787 ± 0.0004 Å
• c: 12.9836 ± 0.0005 Å
• α: 76.188 ± 0.002°
• β: 83.221 ± 0.002°
• γ: 73.4935 ± 0.0019°
• Cell volume: 1246.92 ± 0.09 ų
• Cell temperature: 100 K
• Ambient diffraction temperature: 100 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0311
• Residual factor for significantly intense reflections: 0.0285
• Weighted residual factors for significantly intense reflections: 0.0601
• Weighted residual factors for all reflections included in the refinement: 0.0614
• Goodness-of-fit parameter for all reflections included in the refinement: 1.214
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No