Geometry & MOs

Info

ID:

374514

PubChem CID:

131330728

Reduced:

O3C12H14 (1)

Stoich.:

A3B12C14 (1)

Weight, g/mol:

206.094294

ΔHf, kcal/mol:

-125.39

Dipole, Da:

3.12

IP(EA), eV:

-9.56(-0.61)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

ethyl 6-hydroxy-2,3-dihydro-1H-indene-4-carboxylate

Drug info:

PubChemData

Smile

COC(=O)C1=CC=CC2=C1CC(CC2)O

DOS

IR

Vibrations