|
Point group |
Species |
Name |
Experimental |
Calculated |
SiH2D2 |
silane-d2 |
C2v |
Cs |
NH3NH3 |
Ammonia Dimer |
C2h |
C1 |
C4H6 |
1-Methylcyclopropene |
C1 |
Cs |
HCONHCH3 |
N-methylformamide |
Cs |
C1 |
CH3COCH3 |
Acetone |
C2v |
C2 |
CH3COCH3 |
Acetone |
C2v |
C2 |
C3H5Cl |
1-Propene, 3-chloro- |
Cs |
C1 |
CH2ClCH2OH2+ |
2-chloroethanol, protonated |
C1 |
Cs |
C(NH2)H2CH2CH2CH3 |
1-Butanamine |
C1 |
Cs |
CH3COOCH3 |
methyl acetate |
Cs |
C1 |
C6H10 |
3-Hexyne |
C2v |
C2 |
C6H12 |
Cyclohexane |
D3d |
S6 |
C6H14 |
Butane, 2,2-dimethyl- |
C1 |
Cs |
HCONH2CN2H4 |
formamide aminomethanimine dimer |
Cs |
C1 |
C3H5Cl3 |
Propane, 1,2,3-trichloro- |
Cs |
C1 |
C6H5CHCH2 |
Styrene |
Cs |
C1 |
C6H5CH2CH3 |
Ethylbenzene |
Cs |
C1 |
C6H12O2 |
Hexanoic acid |
Cs |
C1 |