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Information card for entry 4514945
Preview
Coordinates | 4514945.cif |
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Original paper (by DOI) | HTML |
Formula | C34 H18 Cu N4 O14 |
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Calculated formula | C34 H18 Cu N4 O14 |
Title of publication | Selective Adsorption of Water, Methanol, and Ethanol by Naphthalene Diimide-Based Coordination Polymers with Constructed Open Cu<sup>2+</sup> Metal Sites and Separation of Ethanol/Acetonitrile. |
Authors of publication | Li, Guo-Bi; Song, Bai-Qiao; Wang, Shi-Qiang; Pei, Ling-Min; Liu, Sheng-Gui; Song, Jiang-Li; Yang, Qing-Yuan |
Journal of publication | ACS omega |
Year of publication | 2019 |
Journal volume | 4 |
Journal issue | 1 |
Pages of publication | 1995 - 2000 |
a | 17.033 ± 0.002 Å |
b | 28.521 ± 0.006 Å |
c | 15.29 ± 0.002 Å |
α | 90° |
β | 90° |
γ | 90° |
Cell volume | 7428 ± 2 Å3 |
Cell temperature | 293 ± 2 K |
Ambient diffraction temperature | 293 ± 2 K |
Number of distinct elements | 5 |
Space group number | 68 |
Hermann-Mauguin space group symbol | C c c a :2 |
Hall space group symbol | -C 2a 2ac |
Residual factor for all reflections | 0.1795 |
Residual factor for significantly intense reflections | 0.1284 |
Weighted residual factors for significantly intense reflections | 0.3211 |
Weighted residual factors for all reflections included in the refinement | 0.3441 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.938 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
Revision | Date | Message | Files |
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220111 (current) | 2019-10-28 | cif/ Adding structures of 4514945 via cif-deposit CGI script. |
4514945.cif |
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