Geometry & MOs

Info

ID:	267913
PubChem CID:	103590288
Reduced:	FN3H14C15 (1)
Stoich.:	AB3C14D15 (1)
Weight, g/mol:	270.153227
ΔH_f, kcal/mol:	16.86
Dipole, Da:	3.25
IP(EA), eV:	-8.5(-0.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-fluoro-5-methyl-1-N-(1,2,3,4-tetrahydronaphthalen-2-yl)benzene-1,2-diamine

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1F)N)NC2=CC=C(C=C2)CC#N

DOS

IR

Vibrations