Geometry & MOs

Info

ID:

48839

PubChem CID:

11528386

Reduced:

O3C8H12 (1)

Stoich.:

A3B8C12 (1)

Weight, g/mol:

156.11503

ΔHf, kcal/mol:

-143.28

Dipole, Da:

3.86

IP(EA), eV:

-10.7(0.63)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

2-ethyl-3-methylcyclohex-3-ene-1,2-diol

Drug info:

PubChemData

Smile

C[C@H]1[C@@H](C[C@@H]2C[C@H]1OC2=O)O

DOS

IR

Vibrations