Geometry & MOs

Info

ID:	33625
PubChem CID:	7887267
Reduced:	NSO3H17C19 (1)
Stoich.:	ABC3D17E19 (1)
Weight, g/mol:	366.067428
ΔH_f, kcal/mol:	-69.0
Dipole, Da:	7.09
IP(EA), eV:	-9.07(-1.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-oxo-2-(3-oxo-2,4-dihydroquinoxalin-1-yl)ethyl] 1-benzothiophene-2-carboxylate

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)CNC(=O)COC(=O)C2=CC3=CC=CC=C3S2

DOS

IR

Vibrations