Geometry & MOs

Info

ID:	361110
PubChem CID:	127302026
Reduced:	SO2N4C12H22 (1)
Stoich.:	AB2C4D12E22 (1)
Weight, g/mol:	359.19574
ΔH_f, kcal/mol:	-82.59
Dipole, Da:	2.84
IP(EA), eV:	-8.57(-0.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(1,4-dimethylpiperazin-2-yl)methyl]-1-ethyl-2,3-dioxo-4H-quinoxaline-6-carboxamide

Drug info:

PubChemData

Smile

CN1CCN(C(C1)CNC(=O)CN2CSCC2=O)C

DOS

IR

Vibrations