Direct sum of irreducible representation
Ag |
Bg |
Au |
Bu |
5 |
2 |
2 |
5 |
Properties of derivatives and isotopomers by single substitution, h(C2h)=4
Atom Set* | Site Symmetry** | h(Site Symmetry) | Identical Atoms*** | Element | Chrial | Polar | Isotopomer |
---|
Isotope | Mass | Abundance**** |
---|
1 | Cs |
2 | 2 | C | no | yes | 13C | 59.0816 | 2.1249 |
2 | Cs |
2 | 2 | C | no | yes | 13C | 59.0816 | 2.1249 |
3 | Cs |
2 | 2 | H | no | yes | 2H | 59.0845 | 0.029808 |
4 | C1 |
1 | 4 | H | yes | yes | 2H | 59.0845 | 0.059616 |
5 | C1 |
1 | 4 | H | yes | yes | 2H | 59.0845 | 0.059616 |
Total Number of Atoms: | 14 | ✅ Correct Number of Atoms found |
*Atom Orbit
**Subgroup of point group C
2h
***Calculated as h( C
2h)/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 | 2 |
Double | X2 | 13 | 18 |
Double | XY | 15 | 38 |
Triple | X3 | 22 | 80 |
Triple | X2Y | 42 | 252 |
Triple | XYZ | 60 | 516 |
Quadruple | X4 | 51 | 230 |
Quadruple | X3Y | 90 | 956 |
Quadruple | X2Y2 | 132 | 1.446 |
Quadruple | X2YZ | 150 | 2.928 |
Quadruple | WXYZ | 180 | 5.916 |
Quintuple | X5 | 61 | 470 |
Quintuple | VWXYZ | 360 | 59.880 |
Sextuple | X6 | 95 | 712 |
Sextuple | UVWXYZ | 360 | 540.360 |
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 |
C2 |
i |
σh |
42 |
0 |
0 |
6 |