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Information card for entry 1520502
Preview
Coordinates | 1520502.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C37 H20 F4 N4 O4 |
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Calculated formula | C37 H20 F4 N4 O4 |
SMILES | c1(C#N)c(c(c(C#N)c2Oc3c(cc4c(c3)C(C)(C)CC34CC(C)(C)c4c3cc3Oc5c(c(C#N)c(c(c5C#N)F)F)Oc3c4)Oc12)F)F |
Title of publication | Synthesis of perfectly alternating copolymers for polymers of intrinsic microporosity |
Authors of publication | Zhang, Jian; Jin, Jianyong; Cooney, Ralph; Fu, Qiang; Qiao, Greg G.; Thomas, Sylvie; Merkel, Tim C. |
Journal of publication | Polym. Chem. |
Year of publication | 2015 |
Journal volume | 6 |
Journal issue | 28 |
Pages of publication | 5003 |
a | 22.674 ± 0.003 Å |
b | 10.0584 ± 0.0012 Å |
c | 13.4593 ± 0.0016 Å |
α | 90° |
β | 99.514 ± 0.009° |
γ | 90° |
Cell volume | 3027.4 ± 0.7 Å3 |
Cell temperature | 372 ± 2 K |
Ambient diffraction temperature | 372 ± 2 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 | 0.1625 |
Residual factor for significantly intense reflections | 0.0728 |
Weighted residual factors for significantly intense reflections | 0.1649 |
Weighted residual factors for all reflections included in the refinement | 0.2117 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.011 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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The link is: https://www.crystallography.net/1520502.html
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