Geometry & MOs

Info

ID:	20100
PubChem CID:	579313
Reduced:	FO2C17H25 (1)
Stoich.:	AB2C17D25 (1)
Weight, g/mol:	280.183858
ΔH_f, kcal/mol:	-154.82
Dipole, Da:	0.82
IP(EA), eV:	-10.08(-0.84)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-ethyloctan-3-yl 3-fluorobenzoate

Drug info:

PubChemData

Smile

CCC(CC)CCC(CC)OC(=O)C1=CC(=CC=C1)F

DOS

IR

Vibrations