Geometry & MOs

Info

ID:	51179
PubChem CID:	12013813
Reduced:	ClN2O2H9C11 (1)
Stoich.:	AB2C2D9E11 (1)
Weight, g/mol:	237.04308
ΔH_f, kcal/mol:	0.32
Dipole, Da:	1.2
IP(EA), eV:	-9.43(-0.88)
Spin(S_z, S²):	None, None
Charge, e:	1

Chem-info

IUPAC name:

(E)-2-[(E)-3-(4-chlorophenyl)prop-2-enoxy]-2-hydroxyethenediazonium

Drug info:

PubChemData

Smile

C1=CC(=CC=C1/C=C/CO/C(=C/[N+]#N)/[O-])Cl

DOS

IR

Vibrations