Zobrazeno 1 - 10
of 33
pro vyhledávání: '"F. P. Van Remoortere"'
Publikováno v:
Bulletin des Sociétés Chimiques Belges. 78:479-485
The semi-empirical LCAO—SCF—MO method described in the first paper of this series is applied to the molecules of indole, imidazole, indolizine, carbazole, benzfuran and dibenzfuran.
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::5b4cf2fbc9291e91275076337b79013c
https://doi.org/10.1002/bscb.19690780906
https://doi.org/10.1002/bscb.19690780906
Publikováno v:
Bulletin des Sociétés Chimiques Belges. 78:407-420
The classical parameters of the nitrogen and oxygen atoms in their characteristic valence states are evaluated semi-empirically in the formalism of the LCAO — SCF — MO method using a few molecular empirical data.
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::5d7cc971444f60485a83dc0944c2aad1
https://doi.org/10.1002/bscb.19690780709
https://doi.org/10.1002/bscb.19690780709
Publikováno v:
Bulletin des Sociétés Chimiques Belges. 76:639-650
Some characteristic parameters of the nitrogen atom are evaluated semi-empirically in the expressions of the LCAO-MO method, using the first singlet-singlet transition energy of pyridine and results previously obtained in a study of conjugated hydroc
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::d5b0dbc848105b30c55a5667b575d8b2
https://doi.org/10.1002/bscb.19670761109
https://doi.org/10.1002/bscb.19670761109
Publikováno v:
Bulletin des Sociétés Chimiques Belges. 77:201-211
The matrix elements HSCFpq obtained by the method described in the previous papers are analysed and classified in order to establish rules for the determination of the Huckel parameters α et β of any aza-derivatives of the conjugated hydrocarbons.
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::bc77b80893650cc9bca4e4ef9c1c9163
https://doi.org/10.1002/bscb.19680770310
https://doi.org/10.1002/bscb.19680770310
Publikováno v:
Acta Crystallographica Section B Structural Crystallography and Crystal Chemistry. 32:370-376
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::7708d02c05f79774a882404bb2ea0997
https://doi.org/10.1107/s0567740876003063
https://doi.org/10.1107/s0567740876003063
Publikováno v:
Inorganic Chemistry. 14:734-740
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::19a39c6631f33267c4cba040b4db20da
https://doi.org/10.1021/ic50146a006
https://doi.org/10.1021/ic50146a006
Publikováno v:
Inorganic Chemistry. 13:2826-2834
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::6db27b6429568db2a58164bde15cae62
https://doi.org/10.1021/ic50142a013
https://doi.org/10.1021/ic50142a013
Publikováno v:
Acta Crystallographica Section B Structural Crystallography and Crystal Chemistry. 31:1420-1426
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::8e6db0517d4ec5b65735230779622485
https://doi.org/10.1107/s0567740875005328
https://doi.org/10.1107/s0567740875005328
Autor:
J. J. Flynn, F. P. van Remoortere
Publikováno v:
Acta Crystallographica Section B Structural Crystallography and Crystal Chemistry. 32:402-407
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::8050a69d5ab300751647c0928ae41c37
https://doi.org/10.1107/s0567740876003117
https://doi.org/10.1107/s0567740876003117
Publikováno v:
Inorganic Chemistry. 10:2313-2319
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_________::865d16ac0c49057c2d027695489b3a33
https://doi.org/10.1021/ic50104a045
https://doi.org/10.1021/ic50104a045