Geometry & MOs

Info

ID:	337312
PubChem CID:	127256994
Reduced:	NO3C10H11 (1)
Stoich.:	AB3C10D11 (1)
Weight, g/mol:	265.073893
ΔH_f, kcal/mol:	-90.31
Dipole, Da:	2.86
IP(EA), eV:	-10.09(-1.21)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2-oxo-1H-naphthalen-1-yl) pyridine-3-carboxylate

Drug info:

PubChemData

Smile

CC(C)(C=O)OC(=O)C1=CN=CC=C1

DOS

IR

Vibrations