Geometry & MOs

Info

ID:	411381
PubChem CID:	135084204
Reduced:	NOC5H5 (2)
Stoich.:	ABC5D5 (2)
Weight, g/mol:	191.082053
ΔH_f, kcal/mol:	-12.31
Dipole, Da:	1.64
IP(EA), eV:	-9.34(-0.81)
Spin(S_z, S²):	None, None
Charge, e:	1

Chem-info

IUPAC name:

(Z)-2-(2,6-dimethylphenoxy)-2-hydroxyethenediazonium

Drug info:

PubChemData

Smile

CC1=C(C(=CC=C1)C)O/C(=C\[N+]#N)/[O-]

DOS

IR

Vibrations