Geometry & MOs

Info

ID:	290968
PubChem CID:	111677732
Reduced:	O2F4N4C19H20 (1)
Stoich.:	A2B4C4D19E20 (1)
Weight, g/mol:	487.07682
ΔH_f, kcal/mol:	-200.17
Dipole, Da:	8.36
IP(EA), eV:	-9.21(-0.6)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(1,3-benzodioxol-5-ylmethyl)-3-[2-(4-fluorophenoxy)propyl]-2-methylguanidine;hydroiodide

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations