Geometry & MOs

Info

ID:	21363
PubChem CID:	588022
Reduced:	F2O2C13H16 (1)
Stoich.:	A2B2C13D16 (1)
Weight, g/mol:	242.111836
ΔH_f, kcal/mol:	-181.41
Dipole, Da:	2.81
IP(EA), eV:	-10.37(-1.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-methylpentyl 2,6-difluorobenzoate

Drug info:

PubChemData

Smile

CC(C)CCCOC(=O)C1=C(C=CC=C1F)F

DOS

IR

Vibrations