Geometry & MOs

Info

ID:	61458
PubChem CID:	26709593
Reduced:	SO2N4C22H26 (1)
Stoich.:	AB2C4D22E26 (1)
Weight, g/mol:	352.178693
ΔH_f, kcal/mol:	15.45
Dipole, Da:	3.82
IP(EA), eV:	-8.78(-0.85)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(3,5-dimethylphenoxy)-N-[[4-(2-oxopyrrolidin-1-yl)phenyl]methyl]acetamide

Drug info:

PubChemData

Smile

C1CCN(CC1)CC2=CC=C(C=C2)CNC(=O)CCC3=NC(=NO3)C4=CSC=C4

DOS

IR

Vibrations