Geometry & MOs

Info

ID:	72960
PubChem CID:	48416731
Reduced:	ClN3O3C17H22 (1)
Stoich.:	AB3C3D17E22 (1)
Weight, g/mol:	339.139448
ΔH_f, kcal/mol:	-115.8
Dipole, Da:	4.74
IP(EA), eV:	-9.07(-0.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[1-[2-(2,4-difluorophenoxy)acetyl]piperidin-3-yl]imidazolidin-2-one

Drug info:

PubChemData

Smile

CC(C(=O)N1CCCC(C1)N2CCNC2=O)OC3=CC=CC=C3Cl

DOS

IR

Vibrations