Geometry & MOs

Info

ID:	139398
PubChem CID:	52522155
Reduced:	SO3N4C18H24 (1)
Stoich.:	AB3C4D18E24 (1)
Weight, g/mol:	389.126323
ΔH_f, kcal/mol:	-89.95
Dipole, Da:	1.44
IP(EA), eV:	-9.03(-0.28)
Spin(S_z, S²):	None, None
Charge, e:	-2

Chem-info

IUPAC name:

4-[(2R)-3-(cyclopropanecarbonyl)-2-(2,4-dimethylphenyl)-4-oxido-5-oxo-2H-pyrrol-1-yl]benzoate

Drug info:

PubChemData

Smile

C[C@H](C1=CC2=C(CCCC2)C=C1)NC(=O)CCN3C=C(C=N3)S(=O)(=O)N

DOS

IR

Vibrations