Geometry & MOs

Info

ID:	387856
PubChem CID:	134987143
Reduced:	N2O3C11H12 (1)
Stoich.:	A2B3C11D12 (1)
Weight, g/mol:	251.115758
ΔH_f, kcal/mol:	-44.77
Dipole, Da:	3.68
IP(EA), eV:	-8.24(-0.94)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 6-(2-ethoxy-2-oxoethyl)-5-methylpyridine-2-carboxylate

Drug info:

PubChemData

Smile

C[N+]1=NC2=C(C=CC(=C2OC)OC)C(=C1)[O-]

DOS

IR

Vibrations