Geometry & MOs

Info

ID:	192508
PubChem CID:	78279235
Reduced:	SO6C12H12 (1)
Stoich.:	AB6C12D12 (1)
Weight, g/mol:	344.081736
ΔH_f, kcal/mol:	-220.86
Dipole, Da:	1.9
IP(EA), eV:	-10.75(-1.3)
Spin(S_z, S²):	None, None
Charge, e:	1

Chem-info

IUPAC name:

1-ethyl-N-(5-ethyl-1,3,4-thiadiazol-2-yl)-2,3-dioxoquinoxalin-1-ium-6-carboxamide

Drug info:

PubChemData

Smile

CS(=O)(=O)C1=CC=CC(=C1)C(=O)OC2CCOC2=O

DOS

IR

Vibrations