Geometry & MOs

Info

ID:	291027
PubChem CID:	111677802
Reduced:	FO2N4C21H33 (1)
Stoich.:	AB2C4D21E33 (1)
Weight, g/mol:	467.10812
ΔH_f, kcal/mol:	-124.66
Dipole, Da:	2.59
IP(EA), eV:	-9.01(-0.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 3-[[ethylamino-[2-(4-fluorophenoxy)propylamino]methylidene]amino]-2-methylpropanoate;hydroiodide

Drug info:

PubChemData

Smile

CCC(CCNC(=NCC(C)OC1=CC=C(C=C1)F)NCC)N2CCCC2=O

DOS

IR

Vibrations