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Volumn 125, Issue 45, 2003, Pages 13793-13803

Novel "Potentially Antiaromatic", Acidichromic Quinonediimines with Tunable Delocalization of Their 6π-Electron Subunits

Author keywords

[No Author keywords available]

Indexed keywords

CHROMOPHORES; ELECTRONIC STRUCTURE; ELECTRONS; PH EFFECTS; SPECTROSCOPIC ANALYSIS; SUPRAMOLECULAR CHEMISTRY; X RAY DIFFRACTION ANALYSIS;

EID: 0242574810     PISSN: 00027863     EISSN: None     Source Type: Journal    
DOI: 10.1021/ja035463u     Document Type: Article
Times cited : (75)

References (47)
  • 1
    • 0004267777 scopus 로고    scopus 로고
    • Royal Society of Chemistry: Cambridge
    • Christie, R. M. Colour Chemistry; Royal Society of Chemistry: Cambridge, 2001.
    • (2001) Colour Chemistry
    • Christie, R.M.1
  • 32
    • 0242478052 scopus 로고    scopus 로고
    • note
    • The interaction between the π subsystems can be compared to that occurring between two atoms of rare gas forced to approach each other. Atomic levels are split by the interaction generating Pauli repulsion, but with no bond and no electron delocalization.
  • 33
    • 0141712315 scopus 로고    scopus 로고
    • Theoretical Chemistry Department, Vrije Universiteit. Amsterdam, The Netherlands
    • ADF user's guide; Theoretical Chemistry Department, Vrije Universiteit. Amsterdam, The Netherlands, 1999.
    • (1999) ADF User's Guide
  • 42
    • 77956972092 scopus 로고    scopus 로고
    • Seminario, J. M., Ed.; Theoretical and Computational Chemistry, Elsevier: Oxford
    • Casida M. E. In Recent Developments of Modern Density Functional Theory; Seminario, J. M., Ed.; Theoretical and Computational Chemistry, Vol. 4; Elsevier: Oxford, 1996, p 391.
    • (1996) Recent Developments of Modern Density Functional Theory , vol.4 , pp. 391
    • Casida, M.E.1
  • 45
    • 0037063789 scopus 로고    scopus 로고
    • For a critical and systematic evaluation of TD-DFT for the calculation of excitation energies in organic chromophores with the hybrid B3LYP functional, see Fabian, J.; Diaz, L. A.; Seifert, G.; Niehaus, T. J. Mol. Struct.: THEOCHEM 2002, 594, 41.
    • (2002) J. Mol. Struct.: THEOCHEM , vol.594 , pp. 41
    • Fabian, J.1    Diaz, L.A.2    Seifert, G.3    Niehaus, T.4
  • 46
    • 0012704871 scopus 로고    scopus 로고
    • Bruker Nonius BV: Delft, The Netherlands
    • (a) KappaCCD Operation Manual; Bruker Nonius BV: Delft, The Netherlands, 1997.
    • (1997) KappaCCD Operation Manual


* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.