| Material | θ-(ET)3Cu2(C2O4)3(CH3OH)2 |
| Temperature | 160.0 K |
| Pressure | Ambient |
| a | 8.6554 Å | α | 104.959 ° |
| b | 16.9210 Å | β | 102.301 ° |
| c | 20.0587 Å | γ | 91.736 ° |
| Volume | 2761.697 Å3 | ||
| Cell setting | Triclinic |
| Spacegroup | P -1 |
| # Symmetry ops. | 2 |
Full analysis view is not currently available for this crystal structure.
Filling used: 0.750
| Band path | |
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| 3-21G | |
| 6-311G | |
| 6-31G | |
| 6-31G* | |
| def2-SVP |
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