Geometry & MOs

Info

ID:	218988
PubChem CID:	85090304
Reduced:	NSO2C20H21 (1)
Stoich.:	ABC2D20E21 (1)
Weight, g/mol:	283.0667
ΔH_f, kcal/mol:	-48.1
Dipole, Da:	4.08
IP(EA), eV:	-8.77(-1.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2,6-dimethylphenyl)sulfanylisoindole-1,3-dione

Drug info:

PubChemData

Smile

CC(C)C1=CC(=CC(=C1)SN2C(=O)C3=CC=CC=C3C2=O)C(C)C

DOS

IR

Vibrations