Geometry & MOs

Info

ID:	132145
PubChem CID:	51313525
Reduced:	FSN2O2C20H21 (1)
Stoich.:	ABC2D2E20F21 (1)
Weight, g/mol:	384.114378
ΔH_f, kcal/mol:	-104.68
Dipole, Da:	3.23
IP(EA), eV:	-8.58(-0.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(1-methylidene-3-oxoisoindol-2-yl)-N-[1-(4-methylsulfonylphenyl)ethyl]acetamide

Drug info:

PubChemData

Smile

C1CSC2=C(C1NC(=O)CCNC(=O)CC3=CC=CC=C3)C=C(C=C2)F

DOS

IR

Vibrations