Geometry & MOs

Info

ID:	22527
PubChem CID:	597449
Reduced:	NO3C8H9 (1)
Stoich.:	AB3C8D9 (1)
Weight, g/mol:	167.058243
ΔH_f, kcal/mol:	-109.16
Dipole, Da:	1.61
IP(EA), eV:	-9.52(-0.77)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 1-methyl-6-oxopyridine-3-carboxylate

Drug info:

PubChemData

Smile

CN1C=C(C=CC1=O)C(=O)OC

DOS

IR

Vibrations