Geometry & MOs

Info

ID:	33683
PubChem CID:	7887487
Reduced:	FNO4H16C17 (1)
Stoich.:	ABC4D16E17 (1)
Weight, g/mol:	331.121986
ΔH_f, kcal/mol:	-166.59
Dipole, Da:	5.65
IP(EA), eV:	-9.54(-0.95)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-(3,4-dimethylanilino)-2-oxoethyl] 2-fluoro-4-methoxybenzoate

Drug info:

PubChemData

Smile

COC1=CC(=C(C=C1)C(=O)OCC(=O)NCC2=CC=CC=C2)F

DOS

IR

Vibrations