Determine point group
| Number of atoms | 9 |
| Sum formula | C4 NiO4 |
| Molecular weight | 169.91 |
| Rotational Analysis | |
|---|---|
| Rotational Constant A (GHz) | 1.0385 |
| Rotational Constant B (GHz) | 1.0385 |
| Rotational Constant C (GHz) | 1.0385 |
| Classification : Spherical top | |
| Symmetry adapted cartesian coordinates | |||||
|---|---|---|---|---|---|
| Atom Number | Atomic Symbol | Atomic Number | x-Coordinate (Angstrom) | y-Coordinate (Angstrom) | z-Coordinate (Angstrom) |
| 1 | Ni | 28 | 0.000000 | 0.000000 | 0.000000 |
| 2 | C | 6 | 1.061170 | 1.061170 | 1.061170 |
| 3 | C | 6 | -1.061170 | -1.061170 | 1.061170 |
| 4 | C | 6 | -1.061170 | 1.061170 | -1.061170 |
| 5 | C | 6 | 1.061170 | -1.061170 | -1.061170 |
| 6 | O | 8 | 1.719926 | 1.719926 | 1.719926 |
| 7 | O | 8 | -1.719926 | -1.719926 | 1.719926 |
| 8 | O | 8 | -1.719926 | 1.719926 | -1.719926 |
| 9 | O | 8 | 1.719926 | -1.719926 | -1.719926 |
| Determined point group | Td |
|---|---|
| Subgroups | Cs , C2 , C3 , D2 , C2v , C3v , D2d , S4 , T |
 3N representation |
||||||
|---|---|---|---|---|---|---|
| group | E | 8C3 | 3C2 | 6S4 | 6 d |
- |
| Td | 27 | 0 | -1 | -1 | 5 | Submit |
| Cs | 27 | - | - | - | 5 | Submit |
| C2 | 27 | - | -1 | - | - | Submit |
| C3 | 27 | 0 | - | - | - | Submit |
| D2 | 27 | - | -1 | - | - | Submit |
| C2v | 27 | - | -1 | - | 5 | Submit |
| C3v | 27 | 0 | - | - | 5 | Submit |
| D2d | 27 | - | -1 | -1 | 5 | Submit |
| S4 | 27 | - | -1 | -1 | - | Submit |
| T | 27 | 0 | -1 | - | - | Submit |
