Geometry & MOs

Info

ID:	199671
PubChem CID:	79280747
Reduced:	ClON4C15H19 (1)
Stoich.:	ABC4D15E19 (1)
Weight, g/mol:	259.153206
ΔH_f, kcal/mol:	38.34
Dipole, Da:	4.97
IP(EA), eV:	-8.77(-0.16)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 4-[2-(2-methoxyethylamino)acetyl]piperazine-1-carboxylate

Drug info:

PubChemData

Smile

CCC1=NN(C2=C1N=C(N2CCC3=CC=CO3)C(C)Cl)C

DOS

IR

Vibrations