Geometry & MOs

Info

ID:	429984
PubChem CID:	135170041
Reduced:	OF6C12H16 (1)
Stoich.:	AB6C12D16 (1)
Weight, g/mol:	366.070799
ΔH_f, kcal/mol:	-262.35
Dipole, Da:	4.14
IP(EA), eV:	-8.38(-1.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(4-acetylanilino)-4-(dimethylamino)-2-sulfosulfanylbenzene

Drug info:

PubChemData

Smile

CC(C1=CC(CC(C1)C(F)(F)F)CC(F)(F)F)OC

DOS

IR

Vibrations