Geometry & MOs

Info

ID:	74225
PubChem CID:	48421605
Reduced:	O3N4C18H22 (1)
Stoich.:	A3B4C18D22 (1)
Weight, g/mol:	363.179421
ΔH_f, kcal/mol:	-64.42
Dipole, Da:	3.27
IP(EA), eV:	-8.43(-0.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 4-[2-(methoxycarbonylamino)-3-phenylpropanoyl]piperazine-1-carboxylate

Drug info:

PubChemData

Smile

CCN(CC)C1=NC=C(C=C1)NC(=O)NC2=CC3=C(C=C2)OCCO3

DOS

IR

Vibrations