Geometry & MOs

Info

ID:	198267
PubChem CID:	79078290
Reduced:	NO2C11H17 (1)
Stoich.:	AB2C11D17 (1)
Weight, g/mol:	271.11392
ΔH_f, kcal/mol:	-60.69
Dipole, Da:	2.39
IP(EA), eV:	-8.68(-0.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2-chloro-4-fluorophenyl)-4-(diethylamino)butan-2-one

Drug info:

PubChemData

Smile

CCN(CC)CCC(=O)C1=COC=C1

DOS

IR

Vibrations