Geometry & MOs

Info

ID:	267858
PubChem CID:	103589815
Reduced:	FN3C14H22 (1)
Stoich.:	AB3C14D22 (1)
Weight, g/mol:	226.148141
ΔH_f, kcal/mol:	-44.85
Dipole, Da:	5.45
IP(EA), eV:	-8.07(0.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-N-(3-ethoxypropyl)-4-fluoro-5-methylbenzene-1,2-diamine

Drug info:

PubChemData

Smile

CCN1CCCC1CNC2=C(C=C(C(=C2)C)F)N

DOS

IR

Vibrations