Geometry & MOs

Info

ID:	295967
PubChem CID:	117548710
Reduced:	O2C7H9 (2)
Stoich.:	A2B7C9 (2)
Weight, g/mol:	208.089958
ΔH_f, kcal/mol:	-125.64
Dipole, Da:	4.59
IP(EA), eV:	-8.51(-0.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[3-(3-fluorophenyl)oxetan-3-yl]propan-2-one

Drug info:

PubChemData

Smile

CC(=O)CC1(COC1)C2=CC(=C(C=C2)OC)OC

DOS

IR

Vibrations