Geometry & MOs

Info

ID:	256250
PubChem CID:	103137973
Reduced:	ON3C15H21 (1)
Stoich.:	AB3C15D21 (1)
Weight, g/mol:	226.168128
ΔH_f, kcal/mol:	-7.2
Dipole, Da:	2.81
IP(EA), eV:	-7.86(-0.58)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-ethyl-1-[(5-methyloxolan-2-yl)methyl]piperazin-2-one

Drug info:

PubChemData

Smile

CCCCOCCNC1=C2C=NC=CC2=C(C=C1)N

DOS

IR

Vibrations