Geometry & MOs

Info

ID:	72596
PubChem CID:	48416344
Reduced:	ClSO3N4C18H21 (1)
Stoich.:	ABC3D4E18F21 (1)
Weight, g/mol:	329.210327
ΔH_f, kcal/mol:	-120.15
Dipole, Da:	3.66
IP(EA), eV:	-8.93(-0.88)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[1-[3-(2,4-dimethylphenyl)propanoyl]piperidin-3-yl]imidazolidin-2-one

Drug info:

PubChemData

Smile

C1CC(CN(C1)C(=O)CC2C(=O)NC3=C(S2)C=CC(=C3)Cl)N4CCNC4=O

DOS

IR

Vibrations