Geometry & MOs

Info

ID:	355787
PubChem CID:	127290639
Reduced:	SN2O2C15H22 (1)
Stoich.:	AB2C2D15E22 (1)
Weight, g/mol:	280.124549
ΔH_f, kcal/mol:	-68.91
Dipole, Da:	3.62
IP(EA), eV:	-9.25(-0.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(4-methylpiperidin-1-yl)sulfonyl-1,3-dihydroisoindole

Drug info:

PubChemData

Smile

CC1CC(CN(C1)S(=O)(=O)N2CC3=CC=CC=C3C2)C

DOS

IR

Vibrations