Geometry & MOs

Info

ID:	234742
PubChem CID:	92303416
Reduced:	SO3N4C10H12 (1)
Stoich.:	AB3C4D10E12 (1)
Weight, g/mol:	391.012661
ΔH_f, kcal/mol:	-67.31
Dipole, Da:	5.19
IP(EA), eV:	-9.67(-1.36)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-chloro-3-[(2R)-1-(4-chlorophenyl)-1-oxopropan-2-yl]-8-nitro-1H-quinoxalin-2-one

Drug info:

PubChemData

Smile

C[C@@H]([C@H](C1=CN=C2C(=N1)C(=O)N=C(N2)SC)O)O

DOS

IR

Vibrations