Geometry & MOs

Info

ID:	363044
PubChem CID:	127310075
Reduced:	N2O2C17H22 (1)
Stoich.:	A2B2C17D22 (1)
Weight, g/mol:	350.166414
ΔH_f, kcal/mol:	-92.8
Dipole, Da:	4.11
IP(EA), eV:	-9.03(0.5)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(4-ethylsulfonylpiperazin-1-yl)-2-(1,2,3,4-tetrahydronaphthalen-2-yl)ethanone

Drug info:

PubChemData

Smile

C1CC(C(=O)NC1)NC(=O)CC2CCC3=CC=CC=C3C2

DOS

IR

Vibrations