Geometry & MOs

Info

ID:	144815
PubChem CID:	53417051
Reduced:	FO2N3H6C7 (1)
Stoich.:	AB2C3D6E7 (1)
Weight, g/mol:	220.045962
ΔH_f, kcal/mol:	-6.16
Dipole, Da:	2.53
IP(EA), eV:	-10.24(-2.0)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 3-amino-6-(trifluoromethyl)pyridine-2-carboxylate

Drug info:

PubChemData

Smile

C1=CC(=C(C=C1[N+](=O)[O-])F)C(=N)N

DOS

IR

Vibrations