Geometry & MOs

Info

ID:	174707
PubChem CID:	75806482
Reduced:	ClNO4C20H20 (1)
Stoich.:	ABC4D20E20 (1)
Weight, g/mol:	364.004845
ΔH_f, kcal/mol:	-122.95
Dipole, Da:	1.68
IP(EA), eV:	-8.94(-0.71)
Spin(S_z, S²):	None, None
Charge, e:	-2

Chem-info

IUPAC name:

2-[(3-carbamoyl-7-oxido-5-oxo-7aH-thieno[3,2-b]pyridin-2-yl)sulfanyl]-N-(1H-1,2,4-triazol-5-yl)ethanimidate

Drug info:

PubChemData

Smile

CC(=O)NC(=CC1=CC=CC=C1)C(=O)OCCCOC2=CC=C(C=C2)Cl

DOS

IR

Vibrations