Geometry & MOs

Info

ID:	6399
PubChem CID:	68498
Reduced:	FOC10H11 (1)
Stoich.:	ABC10D11 (1)
Weight, g/mol:	166.079393
ΔH_f, kcal/mol:	-74.69
Dipole, Da:	2.74
IP(EA), eV:	-10.15(-0.77)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(4-fluorophenyl)butan-1-one

Drug info:

PubChemData

Smile

CCCC(=O)C1=CC=C(C=C1)F

DOS

IR

Vibrations