Geometry & MOs

Info

ID:

11897

PubChem CID:

122996

Reduced:

SN2O4C7H7 (1)

Stoich.:

AB2C4D7E7 (1)

Weight, g/mol:

215.012653

ΔHf, kcal/mol:

-63.72

Dipole, Da:

3.13

IP(EA), eV:

 0.0(0.0)

Spin(Sz, S2):

 0.500000, 0.899535

Charge, e:

 -1

Chem-info

IUPAC name:

4-(hydroxymethyl)benzenediazonium;sulfite

Drug info:

PubChemData

Smile

C1=CC(=CC=C1CO)[N+]#N.[O-]S(=O)[O-]

DOS

IR

Vibrations