Geometry & MOs

Info

ID:	197945
PubChem CID:	79019600
Reduced:	NOC15H23 (1)
Stoich.:	ABC15D23 (1)
Weight, g/mol:	200.152478
ΔH_f, kcal/mol:	-43.06
Dipole, Da:	3.29
IP(EA), eV:	-8.62(0.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(4-ethylpiperazin-1-yl)-4-hydroxybutan-1-one

Drug info:

PubChemData

Smile

CCOC1=CC=C(C=C1)C(CN)C2CCCC2

DOS

IR

Vibrations