Table 3. Experimental details.
| Crystal data | |
| Chemical formula | C9H12NO+·Br−·CBr4 |
| M r | 561.76 |
| Crystal system, space group | Orthorhombic, Pnma |
| Temperature (K) | 150 |
| a, b, c (Å) | 21.1900 (7), 7.4114 (2), 10.2297 (4) |
| V (Å3) | 1606.55 (9) |
| Z | 4 |
| Radiation type | Mo Kα |
| μ (mm−1) | 12.49 |
| Crystal size (mm) | 0.32 × 0.18 × 0.12 |
| Data collection | |
| Diffractometer | Bruker APEXII CCD |
| Absorption correction | Multi-scan (SADABS; Krause et al., 2015 ▸) |
| Tmin, Tmax | 0.086, 0.254 |
| No. of measured, independent and observed [I > 2σ(I)] reflections | 9073, 1649, 1462 |
| R int | 0.027 |
| (sin θ/λ)max (Å−1) | 0.611 |
| Refinement | |
| R[F2 > 2σ(F2)], wR(F2), S | 0.026, 0.064, 1.06 |
| No. of reflections | 1649 |
| No. of parameters | 98 |
| No. of restraints | 6 |
| H-atom treatment | H-atom parameters constrained |
| Δρmax, Δρmin (e Å−3) | 0.79, −1.21 |