Information card for entry 7705929

Structure parameters

• Chemical name: L+HPO4
• Formula: C80 H97 K2 N8 O20 P
• Calculated formula: C80 H97 K2 N8 O20 P
• SMILES: Cc1ccc(cc1)NC(=O)Nc1c(cccc1)NC(=O)Nc1ccc(cc1)C(=C(c1ccccc1)\c1ccc(cc1)NC(Nc1ccccc1NC(=O)Nc1ccc(cc1)C)=[O][K]12345[O]6CC[O]1CC[O]2CC[O]3CC[O]4CC[O]5CC6)\c1ccccc1.C1C[O]2CC[O]3CC[O]4CC[O]5CC[O]6CC[O]1[K]234561OP(=O)(O)O1
• Title of publication: Stepwise enhancement of fluorescence induced by anion coordination and non-covalent interactions.
• Authors of publication: Zhang, Dan; Zhao, Jie; Cao, Liping; Yang, Dong; Chen, Bozhong; Yu, Le; Yang, Xiao-Juan; Wu, Biao
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2021
• Journal volume: 50
• Journal issue: 1
• Pages of publication: 76 - 80
• a: 12.111 ± 0.002 Å
• b: 17.685 ± 0.003 Å
• c: 25.349 ± 0.005 Å
• α: 74.055 ± 0.004°
• β: 88.954 ± 0.005°
• γ: 74.796 ± 0.004°
• Cell volume: 5029.2 ± 1.6 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.2133
• Residual factor for significantly intense reflections: 0.0994
• Weighted residual factors for significantly intense reflections: 0.2124
• Weighted residual factors for all reflections included in the refinement: 0.2412
• Goodness-of-fit parameter for all reflections included in the refinement: 1.043
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No