1DJ: (1R)-1-phenylprop-2-yn-1-ol
| Best-fitted instance in this entry |
| Other instances in this entry |
| Identifier | Ranking for goodness of fit | Ranking for geometry | Real space R factor | Real space correlation coefficient | RMSZ-bond-length | RMSZ-bond-angle | Outliers of bond length | Outliers of bond angle | Atomic clashes | Stereochemical errors | Model completeness | Average occupancy |
|---|
| 4I7N_1DJ_A_202 | 94% | 38% | 0.085 | 0.983 | 1.84 | 0.66 | 2 | - | 0 | 0 | 100% | 1 |
| 4I7N_1DJ_B_203 | 93% | 23% | 0.084 | 0.981 | 2.22 | 1.12 | 2 | 1 | 0 | 0 | 100% | 1 |
