Geometry & MOs

Info

ID:	291120
PubChem CID:	111677912
Reduced:	FON5C17H24 (1)
Stoich.:	ABC5D17E24 (1)
Weight, g/mol:	514.1241
ΔH_f, kcal/mol:	-20.95
Dipole, Da:	3.8
IP(EA), eV:	-9.16(-0.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-benzyl-3-[[N-[2-(4-fluorophenoxy)propyl]-N'-methylcarbamimidoyl]amino]propanamide;hydroiodide

Drug info:

PubChemData

Smile

CC(CNC(=NC)NCCCN1C=CN=C1)OC2=CC=C(C=C2)F

DOS

IR

Vibrations