Geometry & MOs

Info

ID:	39128
PubChem CID:	8139736
Reduced:	ON2F3C19H21 (1)
Stoich.:	AB2C3D19E21 (1)
Weight, g/mol:	344.155849
ΔH_f, kcal/mol:	-169.96
Dipole, Da:	3.09
IP(EA), eV:	-9.25(-0.52)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[2-[(dimethylamino)methyl]phenyl]methyl]-2-methoxy-4-methylsulfanylbenzamide

Drug info:

PubChemData

Smile

CN(C)CC1=CC=CC=C1CNC(=O)CC2=CC(=CC=C2)C(F)(F)F

DOS

IR

Vibrations