Geometry & MOs

Info

ID:	72789
PubChem CID:	48416547
Reduced:	N3O4C19H27 (1)
Stoich.:	A3B4C19D27 (1)
Weight, g/mol:	331.189592
ΔH_f, kcal/mol:	-151.04
Dipole, Da:	1.79
IP(EA), eV:	-8.27(0.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

COC1=C(C=C(C=C1)CCC(=O)N2CCCC(C2)N3CCNC3=O)OC

DOS

IR

Vibrations