Geometry & MOs

Info

ID:	80576
PubChem CID:	49835235
Reduced:	FOSN8C22H23 (1)
Stoich.:	ABCD8E22F23 (1)
Weight, g/mol:	512.128504
ΔH_f, kcal/mol:	66.05
Dipole, Da:	5.62
IP(EA), eV:	-8.77(-0.66)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[4-[7-tert-butyl-5-(6-methoxy-2-oxo-1H-pyridin-3-yl)quinoxalin-2-yl]-3-chlorophenyl]methanesulfonamide

Drug info:

PubChemData

Smile

CN1CCN(CC1)C2=NC(=NC(=N2)NC3=NNC(=C3)C4=CC=CO4)SCC5=CC=C(C=C5)F

DOS

IR

Vibrations