Geometry & MOs

Info

ID:	137246
PubChem CID:	52176308
Reduced:	SO3N4C19H32 (1)
Stoich.:	AB3C4D19E32 (1)
Weight, g/mol:	366.03153
ΔH_f, kcal/mol:	-129.96
Dipole, Da:	4.3
IP(EA), eV:	-8.91(-0.13)
Spin(S_z, S²):	None, None
Charge, e:	-1

Chem-info

IUPAC name:

(E)-N-(5-carbamoyl-1-methylpyrrol-3-yl)sulfonyl-3-(4-chlorophenyl)prop-2-enimidate

Drug info:

PubChemData

Smile

CCN(CC)[C@H](CNC(=O)NC1CCN(CC1)C(=O)OCC)C2=CSC=C2

DOS

IR

Vibrations