| β/˚ | 100.850(5) |
| γ/˚ | 90 |
| V/Å3 | 3320(2) |
| Z | 8 |
| Dc/g cm−3 | 1.847 |
| µ(Mo Kα)/mm−1 | 1.350 |
| F(000) | 1832 |
| Reflections collected | 10631 |
| Unique reflections | 2918 |
| R(int) | 0.0286 |
| GOF on F2 | 1.023 |
| Final R indices [I > 2sigma(I)] | R1 = 0.0248, wR2 = 0.0563 |
| R indices (all data) | R1 = 0.0320, wR2 = 0.0599 |