Table 2. Experimental details.
| Crystal data | |
| Chemical formula | C14H12INO |
| M r | 337.15 |
| Crystal system, space group | Orthorhombic, P212121 |
| Temperature (K) | 296 |
| a, b, c (Å) | 8.1730 (4), 11.8143 (9), 13.1721 (8) |
| V (Å3) | 1271.88 (14) |
| Z | 4 |
| Radiation type | Mo Kα |
| μ (mm−1) | 2.50 |
| Crystal size (mm) | 0.66 × 0.34 × 0.13 |
| Data collection | |
| Diffractometer | Stoe IPDS 2 |
| Absorption correction | Integration (X-RED32; Stoe & Cie, 2002 ▸) |
| T min, T max | 0.365, 0.784 |
| No. of measured, independent and observed [I > 2σ(I)] reflections | 5163, 2482, 1949 |
| R int | 0.033 |
| (sin θ/λ)max (Å−1) | 0.617 |
| Refinement | |
| R[F 2 > 2σ(F 2)], wR(F 2), S | 0.031, 0.063, 0.92 |
| No. of reflections | 2482 |
| No. of parameters | 160 |
| H-atom treatment | H atoms treated by a mixture of independent and constrained refinement |
| Δρmax, Δρmin (e Å−3) | 0.46, −0.21 |