Geometry & MOs

Info

ID:	74265
PubChem CID:	48421653
Reduced:	ClFNO2C15H19 (1)
Stoich.:	ABCD2E15F19 (1)
Weight, g/mol:	395.184506
ΔH_f, kcal/mol:	-106.88
Dipole, Da:	4.12
IP(EA), eV:	-9.36(-0.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl N-[1-(4-benzoylpiperazin-1-yl)-1-oxo-3-phenylpropan-2-yl]carbamate

Drug info:

PubChemData

Smile

CC(C(=O)N(C)CC1=C(C=CC=C1Cl)F)OCC2CC2

DOS

IR

Vibrations