Geometry & MOs

Info

ID:	70203
PubChem CID:	47211672
Reduced:	NSO3C14H21 (1)
Stoich.:	ABC3D14E21 (1)
Weight, g/mol:	297.139865
ΔH_f, kcal/mol:	-118.55
Dipole, Da:	3.44
IP(EA), eV:	-8.4(0.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[1-(4,5-dimethoxy-2-methylphenyl)ethyl]-2-methylsulfanylpropanamide

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1C(C)NC(=O)CSC)OC)OC

DOS

IR

Vibrations