Geometry & MOs

Info

ID:	283431
PubChem CID:	103980263
Reduced:	ON2C13H20 (1)
Stoich.:	AB2C13D20 (1)
Weight, g/mol:	288.144948
ΔH_f, kcal/mol:	-15.37
Dipole, Da:	4.4
IP(EA), eV:	-9.22(0.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[[(1S)-1-(3-methylphenyl)ethyl]amino]-N-(2,2,2-trifluoroethyl)propanamide

Drug info:

PubChemData

Smile

CC(C1=CC=NC=C1)NCC2(CCC2)OC

DOS

IR

Vibrations