Table 6. Summary of interatomic contacts (Å)a, shorter than the sum of the van der Waals radii, in the crystal structures of I and II .
| Contact | Length | Length − vdW | Symmetry operation |
|---|---|---|---|
| I | |||
| C11⋯C12 | 3.278 | −0.122 |
− x, − − y, − − z
|
| C12⋯H11A | 2.805 | −0.095 |
− x, − − y, − − z
|
| I1⋯H17 | 3.087 | −0.093 | − + x, −y, z
|
| N3⋯H11B | 2.671 | −0.079 |
− x, − − y, − − z
|
| N3⋯C11 | 3.234 | −0.016 |
− x, − − y, − − z
|
| II | |||
| Cl4⋯Cl4 | 3.045 | −0.455 | -x, −y, 2 − z |
| C6⋯H40B | 2.758 | −0.142 | -x, −y, 1 − z |
| C30⋯H3B | 2.779 | −0.121 | 1 − x, −y, 1 − z |
| H23B⋯H23B | 2.287 | −0.113 | 1 − x, 1 − y, 1 − z |
| H6⋯C36 | 2.798 | −0.102 | −1 + x, −1 + y, z |
| Cl1⋯H33 | 2.854 | −0.096 | −1 + x, y, z |
| H6⋯C37 | 2.858 | −0.042 | −1 + x, −1 + y, z |
| H3B⋯H30A | 2.359 | −0.041 | 1 − x, −y, 1 − z |
| H10B⋯H26 | 2.382 | −0.018 | 1 − x, 1 − y, 1 − z |
Note: (a) distances were calculated using Mercury (Macrae et al., 2008 ▸).

