Geometry & MOs

Info

ID:	290977
PubChem CID:	111677743
Reduced:	IF2O2N4C19H23 (1)
Stoich.:	AB2C2D4E19F23 (1)
Weight, g/mol:	376.171082
ΔH_f, kcal/mol:	-117.27
Dipole, Da:	5.02
IP(EA), eV:	-8.86(-0.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[[N-[2-(4-fluorophenoxy)propyl]-N'-methylcarbamimidoyl]amino]-N-(4-fluorophenyl)acetamide

Drug info:

PubChemData

Smile

CC(CNC(=NC)NCC(=O)NC1=CC=C(C=C1)F)OC2=CC=C(C=C2)F.I

DOS

IR

Vibrations