Geometry & MOs

Info

ID:	158305
PubChem CID:	56463327
Reduced:	SO3N4C25H36 (1)
Stoich.:	AB3C4D25E36 (1)
Weight, g/mol:	419.184506
ΔH_f, kcal/mol:	-104.72
Dipole, Da:	8.12
IP(EA), eV:	-8.52(-0.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-acetamido-5-methylphenyl)-3-ethoxy-4-(pyridin-3-ylmethoxy)benzamide

Drug info:

PubChemData

Smile

CC1=CC(=C(C(=C1)C)S(=O)(=O)NCCC(=O)NC(CN2CCN(CC2)C)C3=CC=CC=C3)C

DOS

IR

Vibrations