Geometry & MOs

Info

ID:	77305
PubChem CID:	48426040
Reduced:	SN2O4C16H22 (1)
Stoich.:	AB2C4D16E22 (1)
Weight, g/mol:	310.144806
ΔH_f, kcal/mol:	-151.02
Dipole, Da:	4.22
IP(EA), eV:	-8.45(-0.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(3-chloro-4-methylphenyl)-N-[2-(diethylamino)-2-oxoethyl]propanamide

Drug info:

PubChemData

Smile

CCN(CC)C(=O)CNC(=O)CSC1=CC2=C(C=C1)OCCO2

DOS

IR

Vibrations