Geometry & MOs

Info

ID:	126813
PubChem CID:	50980015
Reduced:	SO3N4C19H24 (1)
Stoich.:	AB3C4D19E24 (1)
Weight, g/mol:	290.210661
ΔH_f, kcal/mol:	-63.78
Dipole, Da:	5.02
IP(EA), eV:	-9.21(-0.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[4-[3-(imidazol-1-ylmethyl)piperidin-1-yl]piperidin-1-yl]ethanone

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)CS(=O)(=O)N2CCN3C(=CC(=N3)C(=O)N4CCCC4)C2

DOS

IR

Vibrations