Geometry & MOs

Info

ID:	287154
PubChem CID:	104233820
Reduced:	FO2C11H11 (1)
Stoich.:	AB2C11D11 (1)
Weight, g/mol:	222.105608
ΔH_f, kcal/mol:	-94.97
Dipole, Da:	6.37
IP(EA), eV:	-9.33(-0.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(2-fluoro-6-methoxyphenyl)-2,2-dimethylcyclobutan-1-one

Drug info:

PubChemData

Smile

COC1=C(C(=CC=C1)F)C2CC(=O)C2

DOS

IR

Vibrations