Geometry & MOs

Info

ID:	175055
PubChem CID:	75849952
Reduced:	NF2O4C21H25 (1)
Stoich.:	AB2C4D21E25 (1)
Weight, g/mol:	320.209993
ΔH_f, kcal/mol:	-245.17
Dipole, Da:	5.57
IP(EA), eV:	-9.02(-0.41)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(2-ethoxyethoxy)-1-[4-(3-methylphenyl)piperazin-1-yl]propan-1-one

Drug info:

PubChemData

Smile

CCOCCOC(C)C(=O)NC1=CC(=C(C=C1)OC(F)F)CC2=CC=CC=C2

DOS

IR

Vibrations