Geometry & MOs

Info

ID:	296185
PubChem CID:	117559449
Reduced:	FN3C12H12 (1)
Stoich.:	AB3C12D12 (1)
Weight, g/mol:	230.121927
ΔH_f, kcal/mol:	10.58
Dipole, Da:	3.09
IP(EA), eV:	-8.72(-0.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-N-(2,4-dimethylphenyl)-3-fluorobenzene-1,2-diamine

Drug info:

PubChemData

Smile

C1=CC(=C(C(=C1)F)NCC2=CC=NC=C2)N

DOS

IR

Vibrations