Geometry & MOs

Info

ID:	248413
PubChem CID:	103081436
Reduced:	ClN2O3C13H17 (1)
Stoich.:	AB2C3D13E17 (1)
Weight, g/mol:	274.112899
ΔH_f, kcal/mol:	-43.65
Dipole, Da:	4.88
IP(EA), eV:	-9.42(-1.58)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 6-[2-(2,2-difluoroethoxy)ethylamino]-2-methylpyridine-3-carboxylate

Drug info:

PubChemData

Smile

COC1CCC(C1)NCC2=C(C=CC(=C2)[N+](=O)[O-])Cl

DOS

IR

Vibrations