Geometry & MOs

Info

ID:	61389
PubChem CID:	26708792
Reduced:	SO2N3H13C17 (1)
Stoich.:	AB2C3D13E17 (1)
Weight, g/mol:	416.155849
ΔH_f, kcal/mol:	31.43
Dipole, Da:	4.44
IP(EA), eV:	-8.91(-1.48)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-benzylsulfanylphenyl)-2-[4-(2-oxopyrrolidin-1-yl)phenyl]acetamide

Drug info:

PubChemData

Smile

C1[C@H](OC2=CC=CC=C21)C(=O)NC3=NN=C(S3)C4=CC=CC=C4

DOS

IR

Vibrations