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Information card for entry 7131682
Preview
Coordinates | 7131682.cif |
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Original paper (by DOI) | HTML |
Formula | C58 H74 F12 N5 O |
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Calculated formula | C58 H74 F12.2737 N5 O |
Title of publication | Transmembrane fluoride anion transport by <i>meso</i>-3,5-bis(trifluoromethyl)phenyl picket calix[4]pyrrole. |
Authors of publication | Patra, Ashoke Kumar; Srimayee, Soumya; Halder, Dibakar; Roy, Anik; Mukherjee, Souvik; Kundu, Somenath; Hossain, Maidul; Saha, Rajat; Lee, Chang-Hee; Manna, Debasis; Saha, Indrajit |
Journal of publication | Chemical communications (Cambridge, England) |
Year of publication | 2023 |
Journal volume | 59 |
Journal issue | 48 |
Pages of publication | 7407 - 7410 |
a | 21.8214 ± 0.0016 Å |
b | 13.2329 ± 0.001 Å |
c | 20.7744 ± 0.0016 Å |
α | 90° |
β | 90° |
γ | 90° |
Cell volume | 5998.8 ± 0.8 Å3 |
Cell temperature | 299 ± 2 K |
Ambient diffraction temperature | 299 ± 2 K |
Number of distinct elements | 5 |
Space group number | 33 |
Hermann-Mauguin space group symbol | P n a 21 |
Hall space group symbol | P 2c -2n |
Residual factor for all reflections | 0.1566 |
Residual factor for significantly intense reflections | 0.073 |
Weighted residual factors for significantly intense reflections | 0.192 |
Weighted residual factors for all reflections included in the refinement | 0.2574 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.021 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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