Geometry & MOs

Info

ID:

15676

PubChem CID:

447223

Reduced:

C3O4H9 (1)

Stoich.:

A3B4C9 (1)

Weight, g/mol:

109.050084

ΔHf, kcal/mol:

-140.3

Dipole, Da:

2.56

IP(EA), eV:

 0.0(0.0)

Spin(Sz, S2):

 0.500000, 0.761681

Charge, e:

 -1

Chem-info

IUPAC name:

propane-1,2,3-triol;hydroxide

Drug info:

PubChemData

Smile

C(C(CO)O)O.[OH-]

DOS

IR

Vibrations