Geometry & MOs

Info

ID:	75057
PubChem CID:	48422929
Reduced:	ClN2O2C17H25 (1)
Stoich.:	AB2C2D17E25 (1)
Weight, g/mol:	418.22162
ΔH_f, kcal/mol:	-65.08
Dipole, Da:	3.12
IP(EA), eV:	-9.02(-0.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl N-[1-[4-(2-morpholin-4-yl-2-oxoethyl)piperazin-1-yl]-1-oxo-3-phenylpropan-2-yl]carbamate

Drug info:

PubChemData

Smile

CC(C(=O)NCC(C1=CC=CC=C1Cl)N(C)C)OCC2CC2

DOS

IR

Vibrations