Geometry & MOs

Info

ID:	151745
PubChem CID:	56310428
Reduced:	N2O2C11H16 (2)
Stoich.:	A2B2C11D16 (2)
Weight, g/mol:	411.215806
ΔH_f, kcal/mol:	-167.14
Dipole, Da:	4.25
IP(EA), eV:	-8.59(-0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 4-[3-methyl-4-[2-oxo-2-(2-phenoxyethylamino)ethyl]piperazin-1-yl]benzoate

Drug info:

PubChemData

Smile

CC1CN(CCN1CC(=O)NC2CCN(CC2)C(=O)C)C3=CC=C(C=C3)C(=O)OC

DOS

IR

Vibrations