Geometry & MOs

Info

ID:	410144
PubChem CID:	135082935
Reduced:	N2O3H20C22 (1)
Stoich.:	A2B3C20D22 (1)
Weight, g/mol:	361.155218
ΔH_f, kcal/mol:	-20.93
Dipole, Da:	8.03
IP(EA), eV:	-8.43(-1.73)
Spin(S_z, S²):	None, None
Charge, e:	1

Chem-info

IUPAC name:

4-hydroxy-3,5-bis[(2-hydroxy-5-methylphenyl)methyl]benzenediazonium

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1)O)CC2=CC(=CC(=C2[O-])CC3=C(C=CC(=C3)C)O)[N+]#N

DOS

IR

Vibrations