Geometry & MOs

Info

ID:	33703
PubChem CID:	7887551
Reduced:	FNO4C15H18 (1)
Stoich.:	ABC4D15E18 (1)
Weight, g/mol:	331.121986
ΔH_f, kcal/mol:	-207.82
Dipole, Da:	6.05
IP(EA), eV:	-9.7(-0.92)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-(2,4-dimethylanilino)-2-oxoethyl] 2-fluoro-4-methoxybenzoate

Drug info:

PubChemData

Smile

COC1=CC(=C(C=C1)C(=O)OCC(=O)NC2CCCC2)F

DOS

IR

Vibrations