Geometry & MOs

Info

ID:	21398
PubChem CID:	588123
Reduced:	FO2C24H39 (1)
Stoich.:	AB2C24D39 (1)
Weight, g/mol:	378.293409
ΔH_f, kcal/mol:	-187.81
Dipole, Da:	0.8
IP(EA), eV:	-10.13(-0.89)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

heptadecyl 3-fluorobenzoate

Drug info:

PubChemData

Smile

CCCCCCCCCCCCCCCCCOC(=O)C1=CC(=CC=C1)F

DOS

IR

Vibrations