Geometry & MOs

Info

ID:	291160
PubChem CID:	111678057
Reduced:	FION5C20H25 (1)
Stoich.:	ABCD5E20F25 (1)
Weight, g/mol:	464.14484
ΔH_f, kcal/mol:	-1.32
Dipole, Da:	3.82
IP(EA), eV:	-8.78(-0.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-(4-fluorophenoxy)propyl]-2-methyl-3-(3-pyrrolidin-1-ylpropyl)guanidine;hydroiodide

Drug info:

PubChemData

Smile

CC(CNC(=NC)NCCC1=CN2C=CC=CC2=N1)OC3=CC=C(C=C3)F.I

DOS

IR

Vibrations