Information card for entry 7711119

Structure parameters

• Formula: C6 H14 Ce N7 O10
• Calculated formula: C6 H14 Ce N7 O10
• Title of publication: S-Heptazine N-Ligand Based Luminescent Coordination Materials: Synthesis, Structural and Luminescent Studies of Lanthanide-Cyamelurate Networks
• Authors of publication: Essalhi, Mohamed; Mohan, Midhun; Marineau-Plante, Gabriel; Schlachter, Adrien Camille; Maris, Thierry; Harvey, Pierre D.; Duong, Adam
• Journal of publication: Dalton Transactions
• Year of publication: 2022
• a: 6.6711 ± 0.0004 Å
• b: 19.7592 ± 0.0012 Å
• c: 21.1063 ± 0.0013 Å
• α: 90°
• β: 98.303 ± 0.002°
• γ: 90°
• Cell volume: 2753 ± 0.3 ų
• Cell temperature: 150 K
• Ambient diffraction temperature: 150.15 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0182
• Residual factor for significantly intense reflections: 0.0175
• Weighted residual factors for significantly intense reflections: 0.0454
• Weighted residual factors for all reflections included in the refinement: 0.0458
• Goodness-of-fit parameter for all reflections included in the refinement: 1.099
• Diffraction radiation wavelength: 1.34139 Å
• Diffraction radiation type: GaKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No