Geometry & MOs

Info

ID:	414227
PubChem CID:	135087183
Reduced:	BrNOH10C15 (1)
Stoich.:	ABCD10E15 (1)
Weight, g/mol:	245.059399
ΔH_f, kcal/mol:	37.94
Dipole, Da:	1.72
IP(EA), eV:	-8.89(-1.02)
Spin(S_z, S²):	None, None
Charge, e:	1

Chem-info

IUPAC name:

2-(2-azido-5-chlorophenyl)-1-methylpyridin-1-ium

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)C(=O)C2=C(C3=CC=CC=C3N2)Br

DOS

IR

Vibrations