Geometry & MOs

Info

ID:	413078
PubChem CID:	135086022
Reduced:	N3O5C19H19 (1)
Stoich.:	A3B5C19D19 (1)
Weight, g/mol:	237.114021
ΔH_f, kcal/mol:	-59.79
Dipole, Da:	5.4
IP(EA), eV:	-8.05(-1.49)
Spin(S_z, S²):	None, None
Charge, e:	1

Chem-info

IUPAC name:

4-(2-azidophenyl)-1-prop-2-enylpyridin-1-ium

Drug info:

PubChemData

Smile

COC1=C(C=C2C(=C1)C(=CN2)CCNC(=O)C3=CC=CC=C3[N+](=O)[O-])OC

DOS

IR

Vibrations