Geometry & MOs

Info

ID:	129541
PubChem CID:	51073016
Reduced:	SO2N3C16H17 (1)
Stoich.:	AB2C3D16E17 (1)
Weight, g/mol:	250.168128
ΔH_f, kcal/mol:	-22.37
Dipole, Da:	4.95
IP(EA), eV:	-9.31(-1.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1-methoxypropan-2-yl)-3-(2-methylanilino)propanamide

Drug info:

PubChemData

Smile

C1CC1N2CC(CC2=O)C(=O)NCC3=NC4=CC=CC=C4S3

DOS

IR

Vibrations