Table 2. Experimental details.
| Crystal data | |
| Chemical formula | [ZnCl2(C13H11N3)]·C3H7NO |
| M r | 418.61 |
| Crystal system, space group | Monoclinic, P21/n |
| Temperature (K) | 296 |
| a, b, c (Å) | 10.9394 (9), 13.3041 (7), 13.1665 (11) |
| β (°) | 106.140 (7) |
| V (Å3) | 1840.7 (2) |
| Z | 4 |
| Radiation type | Mo Kα |
| μ (mm−1) | 1.64 |
| Crystal size (mm) | 0.60 × 0.50 × 0.39 |
| Data collection | |
| Diffractometer | Stoe IPDS 2 |
| Absorption correction | Integration (X-RED32; Stoe & Cie, 2002 ▸) |
| T min, T max | 0.460, 0.567 |
| No. of measured, independent and observed [I > 2σ(I)] reflections | 19616, 5643, 3891 |
| R int | 0.036 |
| (sin θ/λ)max (Å−1) | 0.717 |
| Refinement | |
| R[F 2 > 2σ(F 2)], wR(F 2), S | 0.037, 0.097, 1.04 |
| No. of reflections | 5643 |
| No. of parameters | 219 |
| H-atom treatment | H-atom parameters constrained |
| Δρmax, Δρmin (e Å−3) | 0.34, −0.62 |