Geometry & MOs

Info

ID:	413774
PubChem CID:	135086724
Reduced:	O3N4C15H18 (1)
Stoich.:	A3B4C15D18 (1)
Weight, g/mol:	295.08067
ΔH_f, kcal/mol:	-38.03
Dipole, Da:	3.58
IP(EA), eV:	-8.57(-0.71)
Spin(S_z, S²):	None, None
Charge, e:	1

Chem-info

IUPAC name:

4-[2-azido-5-(trifluoromethoxy)phenyl]-1-methylpyridin-1-ium

Drug info:

PubChemData

Smile

CC(C)(C)OC(=O)N1C2=C(C=C(C=C2)OC)C=C1CN=[N+]=[N-]

DOS

IR

Vibrations