Geometry & MOs

Info

ID:	72739
PubChem CID:	48416494
Reduced:	N3O4C18H25 (1)
Stoich.:	A3B4C18D25 (1)
Weight, g/mol:	391.210721
ΔH_f, kcal/mol:	-149.54
Dipole, Da:	4.89
IP(EA), eV:	-8.67(-0.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[1-[3-(3,4,5-trimethoxyphenyl)propanoyl]piperidin-3-yl]imidazolidin-2-one

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations