Geometry & MOs

Info

ID:	355813
PubChem CID:	127290665
Reduced:	SO2N6C15H24 (1)
Stoich.:	AB2C6D15E24 (1)
Weight, g/mol:	362.141262
ΔH_f, kcal/mol:	-29.66
Dipole, Da:	3.81
IP(EA), eV:	-8.68(0.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1=C(C(=NN1C)C)S(=O)(=O)N2CCN(CC2)CC3=NC=CN3C

DOS

IR

Vibrations