Geometry & MOs

Info

ID:	280088
PubChem CID:	103846773
Reduced:	NO2C10H17 (1)
Stoich.:	AB2C10D17 (1)
Weight, g/mol:	295.085384
ΔH_f, kcal/mol:	-56.54
Dipole, Da:	4.79
IP(EA), eV:	-9.98(0.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-methylsulfinyl-N-[[3-(trifluoromethoxy)phenyl]methyl]propan-1-amine

Drug info:

PubChemData

Smile

CCCC(CCO)CNC(=O)C#C

DOS

IR

Vibrations