Geometry & MOs

Info

ID:	267852
PubChem CID:	103589748
Reduced:	FN4C16H19 (1)
Stoich.:	AB4C16D19 (1)
Weight, g/mol:	224.168877
ΔH_f, kcal/mol:	5.28
Dipole, Da:	1.23
IP(EA), eV:	-8.38(0.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-N-butyl-1-N-ethyl-4-fluoro-5-methylbenzene-1,2-diamine

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1F)N)N2CCN(CC2)C3=CC=CC=N3

DOS

IR

Vibrations