Geometry & MOs

Info

ID:	366124
PubChem CID:	127319485
Reduced:	SO3N4C15H20 (1)
Stoich.:	AB3C4D15E20 (1)
Weight, g/mol:	366.124943
ΔH_f, kcal/mol:	-87.83
Dipole, Da:	5.81
IP(EA), eV:	-8.82(-0.61)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1,1-dioxothian-3-yl)-1-(2-methoxyphenyl)-5-oxopyrrolidine-3-carboxamide

Drug info:

PubChemData

Smile

CC1=CC(=C2C(=NN(C2=N1)C)C)C(=O)NC3CCCS(=O)(=O)C3

DOS

IR

Vibrations