Geometry & MOs

Info

ID:	33712
PubChem CID:	7887660
Reduced:	FNSO6C19H20 (1)
Stoich.:	ABCD6E19F20 (1)
Weight, g/mol:	285.101251
ΔH_f, kcal/mol:	-261.03
Dipole, Da:	5.2
IP(EA), eV:	-9.2(-0.82)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CCC1=CC(=C(S1)NC(=O)COC(=O)C2=C(C=C(C=C2)OC)F)C(=O)OCC

DOS

IR

Vibrations