Geometry & MOs

Info

ID:	70438
PubChem CID:	48413352
Reduced:	SN2O6C14H18 (1)
Stoich.:	AB2C6D14E18 (1)
Weight, g/mol:	381.099457
ΔH_f, kcal/mol:	-132.76
Dipole, Da:	5.2
IP(EA), eV:	-10.12(-1.96)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 3-[cyclopropyl-[(2,3-dioxo-1,4-dihydroquinoxalin-6-yl)sulfonyl]amino]propanoate

Drug info:

PubChemData

Smile

CCOC(=O)CCN(C1CC1)S(=O)(=O)C2=CC=C(C=C2)[N+](=O)[O-]

DOS

IR

Vibrations