Table 2. Experimental details.
| Crystal data | |
| Chemical formula | C6H8NO+·C2H3O2 − |
| M r | 169.18 |
| Crystal system, space group | Monoclinic, P21/c |
| Temperature (K) | 100 |
| a, b, c (Å) | 9.9150 (2), 7.2523 (2), 11.9573 (3) |
| β (°) | 98.558 (2) |
| V (Å3) | 850.23 (4) |
| Z | 4 |
| Radiation type | Mo Kα |
| μ (mm−1) | 0.10 |
| Crystal size (mm) | 0.10 × 0.10 × 0.08 |
| Data collection | |
| Diffractometer | Oxford Diffraction Xcalibur Sapphire2 CCD |
| Absorption correction | Integration (ABSORB; DeTitta, 1985 ▸) |
| T min, T max | 0.966, 0.991 |
| No. of measured, independent and observed [I > 2σ(I)] reflections | 52913, 3105, 2736 |
| R int | 0.038 |
| (sin θ/λ)max (Å−1) | 0.766 |
| Refinement | |
| R[F 2 > 2σ(F 2)], wR(F 2), S | 0.038, 0.109, 1.05 |
| No. of reflections | 3105 |
| No. of parameters | 122 |
| H-atom treatment | H atoms treated by a mixture of independent and constrained refinement |
| Δρmax, Δρmin (e Å−3) | 0.49, −0.27 |