Geometry & MOs

Info

ID:	262019
PubChem CID:	103266593
Reduced:	FNO3C13H18 (1)
Stoich.:	ABC3D13E18 (1)
Weight, g/mol:	289.01137
ΔH_f, kcal/mol:	-158.15
Dipole, Da:	4.33
IP(EA), eV:	-8.59(0.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 2-bromo-3-(2-fluoro-6-methylanilino)propanoate

Drug info:

PubChemData

Smile

CCOC(=O)COCCNC1=C(C=CC=C1F)C

DOS

IR

Vibrations