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Information card for entry 7237061
Preview
Coordinates | 7237061.cif |
---|---|
Original paper (by DOI) | HTML |
Chemical name | TPE TriMacrocycle |
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Formula | C127 H126 Cl9 N5 O18 |
Calculated formula | C127 H126 Cl9 N5 O18 |
Title of publication | Chiroptical property of TPE triangular macrocycle crown ethers from propeller-like chirality induced by chiral acids |
Authors of publication | Qiao, Wei-Guo; Xiong, Jia-Bin; Yuan, Ying-Xue; Zhang, Hong-Chao; Yang, Dong; Liu, Minghua; Zheng, Yan-Song |
Journal of publication | Journal of Materials Chemistry C |
Year of publication | 2018 |
Journal volume | 6 |
Journal issue | 13 |
Pages of publication | 3427 |
a | 14.8602 ± 0.0013 Å |
b | 19.5839 ± 0.0017 Å |
c | 22.2821 ± 0.0018 Å |
α | 102.48 ± 0.002° |
β | 91.023 ± 0.002° |
γ | 97.659 ± 0.003° |
Cell volume | 6267.6 ± 0.9 Å3 |
Cell temperature | 173 ± 2 K |
Ambient diffraction temperature | 173 ± 2 K |
Number of distinct elements | 5 |
Space group number | 2 |
Hermann-Mauguin space group symbol | P -1 |
Hall space group symbol | -P 1 |
Residual factor for all reflections | 0.2594 |
Residual factor for significantly intense reflections | 0.1456 |
Weighted residual factors for significantly intense reflections | 0.3782 |
Weighted residual factors for all reflections included in the refinement | 0.4488 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.355 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | Yes |
Has Fobs | No |
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The link is: https://www.crystallography.net/7237061.html
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