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Information card for entry 7101704
Preview
Coordinates | 7101704.cif |
---|---|
Original paper (by DOI) | HTML |
Common name | para-octanoylcalix(4)arene + acetone |
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Formula | C66 H92 O10 |
Calculated formula | C66 H92 O10 |
Title of publication | A molecular turnstile in para-octanoyl calix[4]arene nanocapsules. |
Authors of publication | Ananchenko, Gennady S; Udachin, Konstantin A; Pojarova, Michaela; Jebors, Said; Coleman, Anthony W; Ripmeester, John A |
Journal of publication | Chemical communications (Cambridge, England) |
Year of publication | 2007 |
Journal issue | 7 |
Pages of publication | 707 - 709 |
a | 12.6317 ± 0.0015 Å |
b | 15.6209 ± 0.0018 Å |
c | 15.658 ± 0.0018 Å |
α | 90.081 ± 0.002° |
β | 104.117 ± 0.002° |
γ | 96.904 ± 0.002° |
Cell volume | 2973.1 ± 0.6 Å3 |
Cell temperature | 125 ± 2 K |
Ambient diffraction temperature | 125 ± 2 K |
Number of distinct elements | 3 |
Space group number | 2 |
Hermann-Mauguin space group symbol | P -1 |
Hall space group symbol | -P 1 |
Residual factor for all reflections | 0.1726 |
Residual factor for significantly intense reflections | 0.1122 |
Weighted residual factors for significantly intense reflections | 0.3413 |
Weighted residual factors for all reflections included in the refinement | 0.3959 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.328 |
Diffraction radiation wavelength | 0.7107 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/7101704.html
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