Geometry & MOs

Info

ID:

413079

PubChem CID:

135086023

Reduced:

N4H13C14 (1)

Stoich.:

A4B13C14 (1)

Weight, g/mol:

287.129671

ΔHf, kcal/mol:

145.82

Dipole, Da:

2.15

IP(EA), eV:

 0.0(0.0)

Spin(Sz, S2):

 0.500000, 1.195153

Charge, e:

 1

Chem-info

IUPAC name:

4-(2-azidophenyl)-1-benzylpyridin-1-ium

Drug info:

PubChemData

Smile

C=CC[N+]1=CC=C(C=C1)C2=CC=CC=C2N=[N+]=[N-]

DOS

IR

Vibrations