Geometry & MOs

Info

ID:	259324
PubChem CID:	103164068
Reduced:	SO2C13H18 (1)
Stoich.:	AB2C13D18 (1)
Weight, g/mol:	250.136908
ΔH_f, kcal/mol:	-64.54
Dipole, Da:	3.67
IP(EA), eV:	-9.3(-0.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(3-ethoxycyclobutyl)-3-(4-fluorophenyl)propan-2-one

Drug info:

PubChemData

Smile

CCOC1CC(C1)CC(=O)CC2=CC=CS2

DOS

IR

Vibrations