Geometry & MOs

Info

ID:	379918
PubChem CID:	134964217
Reduced:	NBr2O2H9C10 (1)
Stoich.:	AB2C2D9E10 (1)
Weight, g/mol:	221.105193
ΔH_f, kcal/mol:	-35.98
Dipole, Da:	3.17
IP(EA), eV:	-10.17(-1.11)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 6-hydroxy-1-methyl-3,4-dihydro-2H-quinoline-7-carboxylate

Drug info:

PubChemData

Smile

CCOC(=O)/C(=C/C1=C(C=NC=C1)Br)/Br

DOS

IR

Vibrations