Geometry & MOs

Info

ID:	364717
PubChem CID:	127316023
Reduced:	ON2C7H11 (2)
Stoich.:	AB2C7D11 (2)
Weight, g/mol:	340.156912
ΔH_f, kcal/mol:	-66.31
Dipole, Da:	4.61
IP(EA), eV:	-9.06(0.54)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-cyclopentylsulfonyl-1-[4-(1H-imidazol-2-ylmethyl)piperazin-1-yl]ethanone

Drug info:

PubChemData

Smile

C1CC(OC1)CC(=O)N2CCN(CC2)CC3=NC=CN3

DOS

IR

Vibrations