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Information card for entry 7130167
Preview
Coordinates | 7130167.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C61 H78 N2 O10 |
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Calculated formula | C61 H78 N2 O10 |
Title of publication | Neutral Isocyanide-Templated Assembly of Pillar[5]arene [2] and [3]Pseudorotaxanes |
Authors of publication | Khamphaijun, Korawit; Namnouad, Phitawat; Docker, Andrew; Ruengsuk, Araya; Tantirungrotechai, Jonggol; Díaz-Torres, Raúl; Harding, David J.; Bunchuay, Thanthapatra |
Journal of publication | Chemical Communications |
Year of publication | 2022 |
a | 13.2049 ± 0.0004 Å |
b | 20.9781 ± 0.0005 Å |
c | 21.1995 ± 0.0006 Å |
α | 102.061 ± 0.002° |
β | 90.23 ± 0.003° |
γ | 92.195 ± 0.002° |
Cell volume | 5738.3 ± 0.3 Å3 |
Cell temperature | 152 ± 3 K |
Ambient diffraction temperature | 152 ± 3 K |
Number of distinct elements | 4 |
Space group number | 2 |
Hermann-Mauguin space group symbol | P -1 |
Hall space group symbol | -P 1 |
Residual factor for all reflections | 0.1333 |
Residual factor for significantly intense reflections | 0.1103 |
Weighted residual factors for significantly intense reflections | 0.3212 |
Weighted residual factors for all reflections included in the refinement | 0.3433 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.293 |
Diffraction radiation probe | x-ray |
Diffraction radiation wavelength | 1.54184 Å |
Diffraction radiation type | CuKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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The link is: https://www.crystallography.net/7130167.html
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