Geometry & MOs

Info

ID:	72903
PubChem CID:	48416667
Reduced:	N4O5C21H22 (1)
Stoich.:	A4B5C21D22 (1)
Weight, g/mol:	403.210721
ΔH_f, kcal/mol:	-75.33
Dipole, Da:	4.76
IP(EA), eV:	-9.34(-1.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[1-[4-(4-acetyl-2-methoxyphenoxy)butanoyl]piperidin-3-yl]imidazolidin-2-one

Drug info:

PubChemData

Smile

C1CC(CN(C1)C(=O)C2=C(C=CC(=C2)[N+](=O)[O-])OC3=CC=CC=C3)N4CCNC4=O

DOS

IR

Vibrations