Geometry & MOs

Info

ID:	26183
PubChem CID:	640217
Reduced:	ClN4H13C19 (1)
Stoich.:	AB4C13D19 (1)
Weight, g/mol:	219.98876
ΔH_f, kcal/mol:	119.41
Dipole, Da:	9.79
IP(EA), eV:	-8.04(-0.72)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-bromo-6-methylnaphthalene

Drug info:

PubChemData

Smile

CN1C=NC2=C1C3=CNC4=CC=CC(=C43)C(=N2)C5=CC=C(C=C5)Cl

DOS

IR

Vibrations