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Coding and Ordering Benzenoids and Their Kekulé Structures (CROSBI ID 44736)

Prilog u knjizi | izvorni znanstveni rad

Lučić, Bono ; Miličević, Ante ; Nikolić, Sonja ; Trinajstić, Nenad Coding and Ordering Benzenoids and Their Kekulé Structures // Carbon Bonding and Structures - Advances in Physics and Chemistry / Mihai, V., Putz (ur.). Dordrecht : Heidelberg : New York (NY) : London: Springer, 2011. str. 205-225

Podaci o odgovornosti

Lučić, Bono ; Miličević, Ante ; Nikolić, Sonja ; Trinajstić, Nenad

engleski

Coding and Ordering Benzenoids and Their Kekulé Structures

The coding and ordering of benzenoids and their Kekule´ structures is discussed. The Wiswesser coding and the binary boundary coding systems are delineated and illustrated. The Wiswesser codes are also used to order cata- and peri-condensed benzenoids. The concept of numeric Kekule´ structure is used for coding and ordering Kekule´ structures of cata-condensed benzenoids. In the case of peri-condensed benzenoids the numeric code of Kekule´ structures is not discriminative enough since there are Kekule´ structures with identical numeric codes. In that case an additional code is needed, and here we suggest the perimeter code.

Benzenoids ; Kekulé structures

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Podaci o prilogu

205-225.

objavljeno

Podaci o knjizi

Carbon Bonding and Structures - Advances in Physics and Chemistry

Mihai, V., Putz

Dordrecht : Heidelberg : New York (NY) : London: Springer

2011.

978-94-007-1732-9

Povezanost rada

Kemija