Geometry & MOs

Info

ID:	72804
PubChem CID:	48416564
Reduced:	O3N4C21H30 (1)
Stoich.:	A3B4C21D30 (1)
Weight, g/mol:	403.247107
ΔH_f, kcal/mol:	-136.92
Dipole, Da:	5.94
IP(EA), eV:	-9.11(-0.51)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[1-(4-hexoxy-3-methoxybenzoyl)piperidin-3-yl]imidazolidin-2-one

Drug info:

PubChemData

Smile

CC1=CC(=CC=C1)C(=O)NC(C(C)C)C(=O)N2CCCC(C2)N3CCNC3=O

DOS

IR

Vibrations