Geometry & MOs

Info

ID:	372695
PubChem CID:	131302691
Reduced:	FNO2C10H12 (1)
Stoich.:	ABC2D10E12 (1)
Weight, g/mol:	197.085207
ΔH_f, kcal/mol:	-128.2
Dipole, Da:	1.65
IP(EA), eV:	-8.65(0.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 2-(4-amino-2-fluoro-5-methylphenyl)acetate

Drug info:

PubChemData

Smile

CC1=C(C=C(C=C1F)CC(=O)OC)N

DOS

IR

Vibrations