Geometry & MOs

Info

ID:	291072
PubChem CID:	111677856
Reduced:	FOSN3C17H22 (1)
Stoich.:	ABCD3E17F22 (1)
Weight, g/mol:	557.1663
ΔH_f, kcal/mol:	-30.27
Dipole, Da:	5.1
IP(EA), eV:	-8.81(-0.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-ethyl-3-[2-(4-fluorophenoxy)propyl]-2-[[6-(2-methylmorpholin-4-yl)pyridin-3-yl]methyl]guanidine;hydroiodide

Drug info:

PubChemData

Smile

CCNC(=NCC1=CSC=C1)NCC(C)OC2=CC=C(C=C2)F

DOS

IR

Vibrations