Information card for entry 7717614

Structure parameters

• Formula: C84 H115 Al3 N4 P2 Y2
• Calculated formula: C84 H115 Al3 N4 P2 Y2
• Title of publication: Phosphaguanidinate Yttrium Carbene, Carbyne and Carbide Complexes: Three Distinct C1 Functionalities
• Authors of publication: Zhang, Lixin; Jiang, Wen
• Journal of publication: Dalton Transactions
• Year of publication: 2024
• a: 19.836 ± 0.0019 Å
• b: 12.2333 ± 0.0012 Å
• c: 34.501 ± 0.003 Å
• α: 90°
• β: 93.891 ± 0.004°
• γ: 90°
• Cell volume: 8352.7 ± 1.4 ų
• Cell temperature: 173 K
• Ambient diffraction temperature: 173 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0506
• Residual factor for significantly intense reflections: 0.0418
• Weighted residual factors for significantly intense reflections: 0.0985
• Weighted residual factors for all reflections included in the refinement: 0.1053
• Goodness-of-fit parameter for all reflections included in the refinement: 1.029
• Diffraction radiation wavelength: 1.34139 Å
• Diffraction radiation type: GaKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No