Information card for entry 7704485

Structure parameters

• Formula: C24 H36 Cl2 Mn N6 O2 P2
• Calculated formula: C24 H36 Cl2 Mn N6 O2 P2
• SMILES: [Mn](Cl)(Cl)([O]=P(n1ccc2ccccc12)(N(C)C)N(C)C)[O]=P(n1ccc2ccccc12)(N(C)C)N(C)C
• Title of publication: Light harvesting indolyl-substituted phosphoramide ligand for the enhancement of Mn(ii) luminescence.
• Authors of publication: Bortoluzzi, Marco; Castro, Jesús; Gobbo, Alberto; Ferraro, Valentina; Pietrobon, Luca
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2020
• Journal volume: 49
• Journal issue: 22
• Pages of publication: 7525 - 7534
• a: 10.35 ± 0.0008 Å
• b: 15.745 ± 0.0013 Å
• c: 18.6481 ± 0.0014 Å
• α: 90°
• β: 99.437 ± 0.002°
• γ: 90°
• Cell volume: 2997.8 ± 0.4 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 7
• 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: 0.0974
• Residual factor for significantly intense reflections: 0.0514
• Weighted residual factors for significantly intense reflections: 0.084
• Weighted residual factors for all reflections included in the refinement: 0.0959
• Goodness-of-fit parameter for all reflections included in the refinement: 1.01
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No