Geometry & MOs

Info

ID:	20101
PubChem CID:	579316
Reduced:	FO2C17H25 (1)
Stoich.:	AB2C17D25 (1)
Weight, g/mol:	280.183858
ΔH_f, kcal/mol:	-156.72
Dipole, Da:	2.11
IP(EA), eV:	-10.19(-0.73)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-ethyloctan-3-yl 4-fluorobenzoate

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations