Table 5. Experimental details.
| Crystal data | |
| Chemical formula | C13H19NO8 |
| M r | 317.29 |
| Crystal system, space group | Triclinic, P
|
| Temperature (K) | 290 |
| a, b, c (Å) | 6.8291 (5), 7.8670 (11), 15.814 (3) |
| α, β, γ (°) | 100.607 (11), 99.011 (10), 105.054 (7) |
| V (Å3) | 787.5 (2) |
| Z | 2 |
| Radiation type | Mo Kα |
| μ (mm−1) | 0.11 |
| Crystal size (mm) | 0.40 × 0.35 × 0.10 |
| Data collection | |
| Diffractometer | Enraf Nonius TurboCAD-4 |
| No. of measured, independent and observed [I > 2σ(I)] reflections | 4880, 4573, 2571 |
| R int | 0.020 |
| (sin θ/λ)max (Å−1) | 0.703 |
| Refinement | |
| R[F 2 > 2σ(F 2)], wR(F 2), S | 0.042, 0.128, 0.99 |
| No. of reflections | 4573 |
| No. of parameters | 203 |
| H-atom treatment | H-atom parameters constrained |
| Δρmax, Δρmin (e Å−3) | 0.18, −0.17 |
