Geometry & MOs

Info

ID:	52981
PubChem CID:	14709335
Reduced:	BrNOC2H4 (1)
Stoich.:	ABCD2E4 (1)
Weight, g/mol:	208.112624
ΔH_f, kcal/mol:	-1.55
Dipole, Da:	1.33
IP(EA), eV:	-10.32(-0.73)
Spin(S_z, S²):	None, None
Charge, e:	1

Chem-info

IUPAC name:

1,3-dimethylbenzo[a]quinolizin-5-ium

Drug info:

PubChemData

Smile

C(/C=N/O)Br

DOS

IR

Vibrations