Geometry & MOs

Info

ID:	72647
PubChem CID:	48416396
Reduced:	FSO2N3C18H20 (1)
Stoich.:	ABC2D3E18F20 (1)
Weight, g/mol:	353.155098
ΔH_f, kcal/mol:	-103.22
Dipole, Da:	6.4
IP(EA), eV:	-8.93(-1.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[1-[2-[4-(difluoromethoxy)phenyl]acetyl]piperidin-3-yl]imidazolidin-2-one

Drug info:

PubChemData

Smile

CC1=C(SC2=CC=CC(=C12)F)C(=O)N3CCCC(C3)N4CCNC4=O

DOS

IR

Vibrations