Geometry & MOs

Info

ID:	414158
PubChem CID:	135087113
Reduced:	NO2C9H13 (2)
Stoich.:	AB2C9D13 (2)
Weight, g/mol:	225.114021
ΔH_f, kcal/mol:	-151.72
Dipole, Da:	4.75
IP(EA), eV:	-8.34(0.18)
Spin(S_z, S²):	None, None
Charge, e:	1

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CCOC(C)(C(C(=O)OC)NCC1=CC2=CC=CC=C2N1)OCC

DOS

IR

Vibrations