Geometry & MOs

Info

ID:	267849
PubChem CID:	103589744
Reduced:	FN3C17H20 (1)
Stoich.:	AB3C17D20 (1)
Weight, g/mol:	210.153227
ΔH_f, kcal/mol:	0.52
Dipole, Da:	1.56
IP(EA), eV:	-8.26(0.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-N-butyl-4-fluoro-1-N,5-dimethylbenzene-1,2-diamine

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1F)N)N2CCN(CC2)C3=CC=CC=C3

DOS

IR

Vibrations