Geometry & MOs

Info

ID:	236337
PubChem CID:	92712418
Reduced:	SN4O4C22H22 (1)
Stoich.:	AB4C4D22E22 (1)
Weight, g/mol:	432.135508
ΔH_f, kcal/mol:	-70.01
Dipole, Da:	5.67
IP(EA), eV:	-9.18(-0.63)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-1-(benzenesulfonyl)-N-[(4-ethoxy-3-methoxyphenyl)methyl]-5-oxopyrrolidine-2-carboxamide

Drug info:

PubChemData

Smile

CN(CC1=CN(N=C1)C2=CC=CC=C2)C(=O)[C@H]3CCC(=O)N3S(=O)(=O)C4=CC=CC=C4

DOS

IR

Vibrations