Geometry & MOs

Info

ID:	61485
PubChem CID:	26709860
Reduced:	SN3O5C21H27 (1)
Stoich.:	AB3C5D21E27 (1)
Weight, g/mol:	352.178693
ΔH_f, kcal/mol:	-172.57
Dipole, Da:	2.83
IP(EA), eV:	-8.38(-1.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(3-methylphenoxy)-N-[2-(2-oxopyrrolidin-1-yl)phenyl]butanamide

Drug info:

PubChemData

Smile

CCN(CC)S(=O)(=O)C1=CC=C(C=C1)C(=O)NCC(=O)NC2=C(C=CC(=C2)C)OC

DOS

IR

Vibrations