Geometry & MOs

Info

ID:	158658
PubChem CID:	56464478
Reduced:	O3N5C26H29 (1)
Stoich.:	A3B5C26D29 (1)
Weight, g/mol:	435.146407
ΔH_f, kcal/mol:	23.38
Dipole, Da:	8.48
IP(EA), eV:	-8.33(-1.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-acetamido-5-methylphenyl)-3-[(3,4-dimethoxyphenyl)sulfonylamino]propanamide

Drug info:

PubChemData

Smile

CN1CCN(CC1)CC(C2=CC=CC=C2)NC(=O)C3=CC(=C(C=C3)NC4=CC=CC=C4)[N+](=O)[O-]

DOS

IR

Vibrations