Geometry & MOs

Info

ID:	11702
PubChem CID:	119376
Reduced:	SN3O4C19H27 (1)
Stoich.:	AB3C4D19E27 (1)
Weight, g/mol:	393.172228
ΔH_f, kcal/mol:	-143.62
Dipole, Da:	4.32
IP(EA), eV:	-8.8(-0.4)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[1-[2-(methanesulfonamido)ethyl]piperidin-4-yl]methyl 1-methylindole-3-carboxylate

Drug info:

PubChemData

Smile

CN1C=C(C2=CC=CC=C21)C(=O)OCC3CCN(CC3)CCNS(=O)(=O)C

DOS

IR

Vibrations