Geometry & MOs

Info

ID:	34060
PubChem CID:	7889639
Reduced:	N2O5C16H16 (1)
Stoich.:	A2B5C16D16 (1)
Weight, g/mol:	399.143035
ΔH_f, kcal/mol:	-147.27
Dipole, Da:	2.31
IP(EA), eV:	-9.57(-0.68)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-[4-(furan-2-carbonyl)piperazin-1-yl]-2-oxoethyl] 2-benzamidoacetate

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C(=O)NCC(=O)OCC(=O)NCC2=CC=CO2

DOS

IR

Vibrations