Information card for entry 4038154
| Formula |
C300.75 H72 N O13.75 |
| Calculated formula |
C49 H65 N O12 |
| Title of publication |
Bringing a Molecular Plus One: Synergistic Binding Creates Guest-Mediated Three Component Complexes. |
| Authors of publication |
Taimoory, S. Maryamdokht; Twum, Kwaku; Dashti, Mohadeseh; Pan, FangFang; Lahtinen, Manu; Rissanen, Kari; Puttreddy, Rakesh; Trant, John F.; Beyeh, Ngong Kodiah |
| Journal of publication |
The Journal of organic chemistry |
| Year of publication |
2020 |
| a |
12.3935 ± 0.0009 Å |
| b |
12.7003 ± 0.001 Å |
| c |
31.989 ± 0.002 Å |
| α |
79.2 ± 0.007° |
| β |
80.931 ± 0.006° |
| γ |
81.646 ± 0.007° |
| Cell volume |
4849.2 ± 0.6 Å3 |
| Cell temperature |
120 ± 0.1 K |
| Ambient diffraction temperature |
120 ± 0.1 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 |
0.1969 |
| Residual factor for significantly intense reflections |
0.1213 |
| Weighted residual factors for significantly intense reflections |
0.2857 |
| Weighted residual factors for all reflections included in the refinement |
0.338 |
| Goodness-of-fit parameter for all reflections included in the refinement |
1.07 |
| Diffraction radiation wavelength |
0.71073 Å |
| Diffraction radiation type |
MoKα |
| Has coordinates |
Yes |
| Has disorder |
Yes |
| Has Fobs |
No |
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https://www.crystallography.net/4038154.html
