Determine point group
| Number of atoms | 8 |
| Sum formula | C2 H2 Cl2 Br2 |
| Molecular weight | 253.79 |
| Rotational Analysis | |
|---|---|
| Rotational Constant A (GHz) | 1.4731 |
| Rotational Constant B (GHz) | 0.5646 |
| Rotational Constant C (GHz) | 0.4134 |
| Ray's asymmetry parameter | -0.7146 |
| Classification : Asymmetric top | |
| Symmetry adapted cartesian coordinates | |||||
|---|---|---|---|---|---|
| Atom Number | Atomic Symbol | Atomic Number | x-Coordinate (Angstrom) | y-Coordinate (Angstrom) | z-Coordinate (Angstrom) |
| 1 | C | 6 | 0.382148 | 0.428939 | -0.505096 |
| 2 | C | 6 | -0.382148 | -0.428939 | 0.505096 |
| 3 | H | 1 | 1.454882 | 0.328735 | -0.379496 |
| 4 | H | 1 | -1.454882 | -0.328735 | 0.379496 |
| 5 | Br | 35 | -0.013339 | -0.148854 | -2.352029 |
| 6 | Br | 35 | 0.013339 | 0.148854 | 2.352029 |
| 7 | Cl | 17 | -0.034457 | 2.162541 | -0.329328 |
| 8 | Cl | 17 | 0.034457 | -2.162541 | 0.329328 |
| Determined point group | Ci |
|---|
 3N representation |
|||
|---|---|---|---|
| group | E | i | - |
| Ci | 24 | 0 | Submit |
