Geometry & MOs

Info

ID:	341361
PubChem CID:	127264054
Reduced:	NOC9H13 (2)
Stoich.:	ABC9D13 (2)
Weight, g/mol:	236.035255
ΔH_f, kcal/mol:	-91.46
Dipole, Da:	4.44
IP(EA), eV:	-9.32(0.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 4-chloro-1,7-naphthyridine-2-carboxylate

Drug info:

PubChemData

Smile

C[C@@H]1C[C@@H](C2(C1)CCN(CC2)C(=O)OCC3=CC=CC=C3)N

DOS

IR

Vibrations