Geometry & MOs

Info

ID:	291031
PubChem CID:	111677806
Reduced:	FSO3N4C18H31 (1)
Stoich.:	ABC3D4E18F31 (1)
Weight, g/mol:	530.11902
ΔH_f, kcal/mol:	-156.7
Dipole, Da:	4.14
IP(EA), eV:	-9.05(-0.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl N-[4-[[[ethylamino-[2-(4-fluorophenoxy)propylamino]methylidene]amino]methyl]phenyl]carbamate;hydroiodide

Drug info:

PubChemData

Smile

CCNC(=NCC(C)OC1=CC=C(C=C1)F)NCCCN(C)S(=O)(=O)CC

DOS

IR

Vibrations