Geometry & MOs

Info

ID:	129454
PubChem CID:	51072644
Reduced:	Cl2N2O2C13H14 (1)
Stoich.:	A2B2C2D13E14 (1)
Weight, g/mol:	306.157957
ΔH_f, kcal/mol:	-89.34
Dipole, Da:	4.41
IP(EA), eV:	-9.83(-0.9)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 4-(3-phenoxypropanoyl)piperazine-1-carboxylate

Drug info:

PubChemData

Smile

C1CC(CN(C1)C(=O)C2=CC(=CC(=C2)Cl)Cl)C(=O)N

DOS

IR

Vibrations