Geometry & MOs

Info

ID:

5819

PubChem CID:

13866

Reduced:

OSC8H11 (1)

Stoich.:

ABC8D11 (1)

Weight, g/mol:

155.053061

ΔHf, kcal/mol:

-26.96

Dipole, Da:

1.2

IP(EA), eV:

 0.0(0.0)

Spin(Sz, S2):

 0.500000, 0.777693

Charge, e:

 1

Chem-info

IUPAC name:

(4-hydroxyphenyl)-dimethylsulfanium

Drug info:

PubChemData

Smile

C[S+](C)C1=CC=C(C=C1)O

DOS

IR

Vibrations