Geometry & MOs

Info

ID:	374540
PubChem CID:	131331263
Reduced:	NO4C11H11 (1)
Stoich.:	AB4C11D11 (1)
Weight, g/mol:	284.01604
ΔH_f, kcal/mol:	-68.38
Dipole, Da:	5.81
IP(EA), eV:	-10.1(-1.58)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 3-bromo-2-methyl-5,6,7,8-tetrahydro-1,6-naphthyridine-4-carboxylate

Drug info:

PubChemData

Smile

CC1=CC(=CC(=C1C)[N+](=O)[O-])C=CC(=O)O

DOS

IR

Vibrations