Geometry & MOs

Info

ID:	33682
PubChem CID:	7887485
Reduced:	FNO4H16C17 (1)
Stoich.:	ABC4D16E17 (1)
Weight, g/mol:	317.106336
ΔH_f, kcal/mol:	-174.13
Dipole, Da:	6.78
IP(EA), eV:	-8.58(-1.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-(benzylamino)-2-oxoethyl] 2-fluoro-4-methoxybenzoate

Drug info:

PubChemData

Smile

CC1=CC=CC=C1NC(=O)COC(=O)C2=C(C=C(C=C2)OC)F

DOS

IR

Vibrations