Geometry & MOs

Info

ID:	357713
PubChem CID:	127294387
Reduced:	SN3O3C17H33 (1)
Stoich.:	AB3C3D17E33 (1)
Weight, g/mol:	379.192963
ΔH_f, kcal/mol:	-153.06
Dipole, Da:	4.81
IP(EA), eV:	-8.58(0.45)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(1,3-dihydro-2-benzofuran-5-ylsulfonyl)-4-[(1-methylpiperidin-2-yl)methyl]piperazine

Drug info:

PubChemData

Smile

CN1CCCCC1CN2CCN(CC2)S(=O)(=O)CC3CCCCO3

DOS

IR

Vibrations