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- W2893148107 abstract "Tetrachlorobenzenes represent one of the best known, but not yet fully understood, group of isomers of the structure–melting point relationship. The differences in melting temperatures of these structurally related compounds were rationalized in terms of the hierarchy and nature of formed noncovalent interactions, and the molecular aggregation that is influenced by molecular symmetry. The highest melting point is associated with the highly symmetric 1,2,4,5-tetrachlorobenzene isomer. The structures of less symmetrical 1,2,3,4-tetrachlorobenzene and 1,2,3,5-tetrachlorobenzene, determined at 270 and 90 K, show a distinct pattern of halogen bonds, characterized by the different numbers and types of interactions. The evolution of Cl...Cl/H distances with temperature indicates the attractive character of intermolecular interactions and their importance to the structural and thermodynamic parameters of isomeric compounds. The favoured Cl...Cl halogen bonds were found to play a decisive role in differentiating the melting temperatures of tetrachlorobenzene isomers. It was also found that, besides the molecular symmetry and ability to form specific intermolecular interactions, both the type and the distribution of interactions are the important factors responsible for the melting behaviour of the studied isomers. The observed preferences, in tetrachlorobenzenes, for the formation of specific noncovalent interactions correspond to the distribution of calculated partial atomic charges and to the magnitudes of electrostatic potential on the molecular surfaces as well as correlate with the enthalpy of melting parameters." @default.
- W2893148107 created "2018-10-05" @default.
- W2893148107 creator A5086563774 @default.
- W2893148107 date "2018-09-27" @default.
- W2893148107 modified "2023-09-26" @default.
- W2893148107 title "Melting point, molecular symmetry and aggregation of tetrachlorobenzene isomers: the role of halogen bonding" @default.
- W2893148107 cites W1548914255 @default.
- W2893148107 cites W1968339413 @default.
- W2893148107 cites W1969360633 @default.
- W2893148107 cites W1970958927 @default.
- W2893148107 cites W1971152942 @default.
- W2893148107 cites W1979368277 @default.
- W2893148107 cites W1979453404 @default.
- W2893148107 cites W1982293718 @default.
- W2893148107 cites W1985415307 @default.
- W2893148107 cites W1994833914 @default.
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- W2893148107 cites W1998211534 @default.
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- W2893148107 cites W2000998616 @default.
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- W2893148107 cites W2030756373 @default.
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- W2893148107 doi "https://doi.org/10.1107/s2052520618012295" @default.
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