Geometry & MOs

Info

ID:	68545
PubChem CID:	46508616
Reduced:	ClN3O5C18H18 (1)
Stoich.:	AB3C5D18E18 (1)
Weight, g/mol:	288.060235
ΔH_f, kcal/mol:	-79.35
Dipole, Da:	9.4
IP(EA), eV:	-9.12(-1.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(1,1-dioxothiolan-3-yl)-(thiophen-2-ylmethyl)amino]acetamide

Drug info:

PubChemData

Smile

CCN(CC1=CC2=C(C=C1)OCO2)CC(=O)NC3=C(C=C(C=C3)[N+](=O)[O-])Cl

DOS

IR

Vibrations