Geometry & MOs

Info

ID:	267861
PubChem CID:	103589875
Reduced:	FIN2H12C13 (1)
Stoich.:	ABC2D12E13 (1)
Weight, g/mol:	294.083827
ΔH_f, kcal/mol:	7.95
Dipole, Da:	2.0
IP(EA), eV:	-8.55(-0.8)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-fluoro-5-methyl-1-N-(4-methylsulfonylphenyl)benzene-1,2-diamine

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations