Direct sum of irreducible representation
A1 |
A2 |
E |
7 |
4 |
11 |
Properties of derivatives and isotopomers by single substitution, h(C3v)=6
Atom Set* | Site Symmetry** | h(Site Symmetry) | Identical Atoms*** | Element | Chrial | Polar | Isotopomer |
---|
Isotope | Mass | Abundance**** |
---|
1 | C1 |
1 | 6 | C | yes | yes | 13C | 265.0973 | 5.2803 |
2 | C1 |
1 | 6 | C | yes | yes | 13C | 265.0973 | 5.2803 |
3 | C1 |
1 | 6 | C | yes | yes | 13C | 265.0973 | 5.2803 |
4 | Cs |
2 | 3 | C | no | yes | 13C | 265.0973 | 2.6401 |
5 | Cs |
2 | 3 | H | no | yes | 2H | 265.1002 | 0.037036 |
6 | Cs |
2 | 3 | H | no | yes | 2H | 265.1002 | 0.037036 |
7 | C1 |
1 | 6 | H | yes | yes | 2H | 265.1002 | 0.074072 |
Total Number of Atoms: | 33 | ✅ Correct Number of Atoms found |
*Atom Orbit
**Subgroup of point group C
3v
***Calculated as h( C
3v)/h(Site Symmetry)
****Natural Abundance of single substituted Isotopomer in %
Numbers of isomers by substitution
Replacement | Pattern | Achiral Isomers | Chiral Isomer Pairs |
Single | X | 3 | 4 |
Double | X2 | 18 | 79 |
Double | XY | 6 | 173 |
Triple | X3 | 46 | 890 |
Triple | X2Y | 48 | 2.704 |
Triple | XYZ | 6 | 5.453 |
Quadruple | X4 | 150 | 6.745 |
Quadruple | X3Y | 90 | 27.235 |
Quadruple | X2Y2 | 300 | 40.770 |
Quadruple | X2YZ | 90 | 81.795 |
Quadruple | WXYZ | 0 | 163.680 |
Quintuple | X5 | 330 | 39.391 |
Quintuple | VWXYZ | 0 | 4.746.720 |
Sextuple | X6 | 770 | 184.228 |
Sextuple | UVWXYZ | 0 | 132.908.160 |
Further Reading
- P.W. Fowler, J. Chem. Soc. Faraday Trans. 91(15) 2241 (1995)
Isomer Counting using Point Group Symmetry
Representation Γ3N
Characters of reducible representation
E |
2C3 |
3σv |
99 |
0 |
3 |