Geometry & MOs

Info

ID:	366966
PubChem CID:	127322025
Reduced:	SN2O3C19H26 (1)
Stoich.:	AB2C3D19E26 (1)
Weight, g/mol:	346.24811
ΔH_f, kcal/mol:	-101.28
Dipole, Da:	4.41
IP(EA), eV:	-9.08(-0.68)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1-propan-2-ylpiperidin-4-yl)-2-(4-pyrazin-2-ylpiperazin-1-yl)acetamide

Drug info:

PubChemData

Smile

CN(CC(=O)N1CCCC2(C1)CCC=CC2)S(=O)(=O)C3=CC=CC=C3

DOS

IR

Vibrations