Geometry & MOs

Info

ID:	21397
PubChem CID:	588122
Reduced:	FO2C24H39 (1)
Stoich.:	AB2C24D39 (1)
Weight, g/mol:	378.293409
ΔH_f, kcal/mol:	-186.71
Dipole, Da:	1.73
IP(EA), eV:	-10.25(-0.81)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

heptadecyl 4-fluorobenzoate

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations