Geometry & MOs

Info

ID:	52977
PubChem CID:	14709322
Reduced:	BrNC14H14 (1)
Stoich.:	ABC14D14 (1)
Weight, g/mol:	293.045486
ΔH_f, kcal/mol:	45.48
Dipole, Da:	3.34
IP(EA), eV:	-8.17(-0.73)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

8-methylbenzo[a]quinolizin-5-ium;perchlorate

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)/C=C/[N+]2=CC=CC=C2.[Br-]

DOS

IR

Vibrations