Geometry & MOs

Info

ID:	291142
PubChem CID:	111677968
Reduced:	FO2N4C19H31 (1)
Stoich.:	AB2C4D19E31 (1)
Weight, g/mol:	502.08772
ΔH_f, kcal/mol:	-131.05
Dipole, Da:	1.83
IP(EA), eV:	-8.95(-0.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CCC(C)NC(=O)CCNC(=NCC(C)OC1=CC=C(C=C1)F)NCC

DOS

IR

Vibrations