Geometry & MOs

Info

ID:	4748
PubChem CID:	11965
Reduced:	FO2C9H9 (1)
Stoich.:	AB2C9D9 (1)
Weight, g/mol:	168.058658
ΔH_f, kcal/mol:	-111.73
Dipole, Da:	1.67
IP(EA), eV:	-10.12(-0.69)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-fluoroethyl benzoate

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C(=O)OCCF

DOS

IR

Vibrations