Geometry & MOs

Info

ID:	291143
PubChem CID:	111677969
Reduced:	FIO3N4C19H24 (1)
Stoich.:	ABC3D4E19F24 (1)
Weight, g/mol:	478.16049
ΔH_f, kcal/mol:	-49.98
Dipole, Da:	4.61
IP(EA), eV:	-8.79(-0.91)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[2-cyclopropyl-2-(dimethylamino)ethyl]-1-ethyl-3-[2-(4-fluorophenoxy)propyl]guanidine;hydroiodide

Drug info:

PubChemData

Smile

CCNC(=NCC1=CC=CC=C1[N+](=O)[O-])NCC(C)OC2=CC=C(C=C2)F.I

DOS

IR

Vibrations