Geometry & MOs

Info

ID:	43297
PubChem CID:	10320863
Reduced:	FOCl2N2C23H27 (1)
Stoich.:	ABC2D2E23F27 (1)
Weight, g/mol:	437.072865
ΔH_f, kcal/mol:	-83.15
Dipole, Da:	4.0
IP(EA), eV:	-8.81(-0.55)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[(3-methyl-2-sulfanylidenequinoxalin-1-yl)diazenyl]-N-pyrimidin-2-ylbenzenesulfonamide

Drug info:

PubChemData

Smile

CC(C1=CC(=CC(=C1)Cl)Cl)N(C)C(=O)CC2(CCN(CC2)C)C3=CC=C(C=C3)F

DOS

IR

Vibrations