Geometry & MOs

Info

ID:	205800
PubChem CID:	80159028
Reduced:	N2O3C15H16 (1)
Stoich.:	A2B3C15D16 (1)
Weight, g/mol:	274.111756
ΔH_f, kcal/mol:	-61.58
Dipole, Da:	6.89
IP(EA), eV:	-9.1(-0.9)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 6-[(3-fluoro-N-methylanilino)methyl]pyridine-3-carboxylate

Drug info:

PubChemData

Smile

CN(CC1=NC=C(C=C1)C(=O)O)C2=CC=CC=C2OC

DOS

IR

Vibrations