Geometry & MOs

Info

ID:	28959
PubChem CID:	830877
Reduced:	N4O4H12C17 (1)
Stoich.:	A4B4C12D17 (1)
Weight, g/mol:	325.158589
ΔH_f, kcal/mol:	53.74
Dipole, Da:	5.34
IP(EA), eV:	-9.27(-2.22)
Spin(S_z, S²):	None, None
Charge, e:	1

Chem-info

IUPAC name:

triethyl-[4-(2-oxopyrrolidin-1-yl)phenyl]sulfonylazanium

Drug info:

PubChemData

Smile

C1=CC2=CC(=CN=NC(=O)C3=CC=C(C=C3)N(O)O)C(=O)N=C2C=C1

DOS

IR

Vibrations