Geometry & MOs

Info

ID:	291057
PubChem CID:	111677836
Reduced:	FSO3N4C21H29 (1)
Stoich.:	ABC3D4E21F29 (1)
Weight, g/mol:	568.17105
ΔH_f, kcal/mol:	-115.07
Dipole, Da:	5.43
IP(EA), eV:	-8.92(-0.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-ethyl-3-[2-(4-fluorophenoxy)propyl]-2-[[3-(piperidine-1-carbonyl)phenyl]methyl]guanidine;hydroiodide

Drug info:

PubChemData

Smile

CCNC(=NCC(C)OC1=CC=C(C=C1)F)NCCS(=O)(=O)NCC2=CC=CC=C2

DOS

IR

Vibrations