Carbon hexoxide

 ( Oxocarbons ) 

Carbon hexoxide or carbon hexaoxide is an oxide of carbon with an unusually large quantity of oxygen. The molecule has been produced and studied at cryogenic temperatures. The molecule is important in atmospheric chemistry and in the study of cold ices in the outer solar system and interstellar space. The substance could form and be present on Ganymede or Triton, moons in the outer solar system. The molecule consists of a six membered ring with five oxygen and one carbon atom, and one oxygen with a double bond with the carbon.

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Shape The molecule that has been observed has a C_s symmetry. The ring is not a flat hexagon but puckered with slightly different side lengths and angles (120°) from the regular hexagon. Going around the ring starting at the carbon to oxygen bond the interatomic distances are C–O: 1.362 Å O–O 1.491 Å, O–O 1.391 Å, O–O 1.391 Å, O–O 1.491 Å, and O–C 1.362 Å. The angles between the bonds are: O–C–O 120.4 °, C–O–O 115.7°, O–O–O 105.9°, and the opposite from carbon O–O–O 104.1°. For the double carbon to oxygen bond, the length is 1.185 Å and the angle from the single bonds is 119.6°.

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Formation

In an experiment, carbon hexoxide was formed by irradiating solid carbon dioxide with electrons at an energy of 5000 eV at 10 K in a vacuum. The reaction proceeds by breaking atomic oxygen from carbon dioxide:

carbon dioxide → carbon monoxide + atomic oxygen

The atomic oxygen then reacts with carbon dioxide to form carbon trioxide, and similar reactions occur to generate the series of ring oxides carbon tetroxide and carbon pentoxide, ultimately leading to the formation of carbon hexoxide in an exothermic reaction.

CO₂ + O → carbon trioxide

O₂CO + O → carbon tetroxide

O₃CO + O → carbon pentoxide

O₄CO + O → O₅CO ΔH = −145.2 kJ mol⁻¹

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Properties

Carbon hexoxide is stable up to 60 K. Vibrational infrared include the most prominent ν₁ = 1876 cm⁻¹ for the most common isotopologue ¹²C¹⁶O₆.

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Other isomers

Other possible isomers of carbon hexoxide are the C₂ form with a five and three membered ring, and the D_2d with two four membered rings. The D_2d O₃CO₃ isomer has a calculated C–O bond length of 1.391 Å, and an O–O length of 1.469 Å. The O–C–O bond angle is 94.1°. However these two isomers have not been observed.

The equivalent carbon hexasulfide is also known from inert gas matrix study. It has C₂ symmetry with the same atomic arrangement as the hexoxide.

Categories: Oxocarbons

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