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Volumn 24, Issue 10, 2005, Pages 2386-2397

Five possible isocyanoazulenes and electron-rich complexes thereof: A quantitative organometallic approach for probing electronic inhomogeneity of the azulenic framework

Author keywords

[No Author keywords available]

Indexed keywords

AZULENE; DELOCALIZATION; INHOMOGENEITY; ISOCYANOZULENES;

EID: 18844362402     PISSN: 02767333     EISSN: None     Source Type: Journal    
DOI: 10.1021/om0502180     Document Type: Article
Times cited : (25)

References (106)
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  • 2
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    • (b) Hansen, H. J. Chimia 1996, 50, 489-496.
    • (1996) Chimia , vol.50 , pp. 489-496
    • Hansen, H.J.1
  • 4
    • 0004118920 scopus 로고
    • Ginsburg, D., Ed.; Interscience Publishers: New York
    • (a) Heilbronner, E. In Non-Benzenoid Aromatic Compounds; Ginsburg, D., Ed.; Interscience Publishers: New York, 1959; pp 171-276.
    • (1959) Non-benzenoid Aromatic Compounds , pp. 171-276
    • Heilbronner, E.1
  • 21
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    • (c) Farrell, T., et al. Dalton 2001, 29-36.
    • (2001) Dalton , pp. 29-36
    • Farrell, T.1
  • 66
  • 69
    • 18844424543 scopus 로고    scopus 로고
    • note
    • 6Az are much more prone to decomposition, especially if acidic impurities are present.
  • 72
    • 84860928987 scopus 로고    scopus 로고
    • 41 in the Experimental Section
    • 41 in the Experimental Section.
  • 74
    • 18844431043 scopus 로고    scopus 로고
    • note
    • 62 can be handled on air for hours without noticeable degradation, we recommend placing it under an inert atmosphere at -20°C for long-term storage.
  • 78
    • 84870676380 scopus 로고    scopus 로고
    • SDBS Database: www.aist.go.jp/RIODB/SDBS/menu-e.html.
    • SDBS Database
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    • 18844373022 scopus 로고    scopus 로고
    • note
    • The shifts are calculated from the UV-vis data reported in this work and in refs 24 and 45-48.
  • 85
    • 0036465612 scopus 로고    scopus 로고
    • 1 excitation energies are significantly smaller than the corresponding HOMO-LUMO separations because of the electron correlation effect: Liu, R. S. H. J. Chem. Educ. 2002, 79, 183-185.
    • (2002) J. Chem. Educ. , vol.79 , pp. 183-185
    • Liu, R.S.H.1
  • 86
    • 18844457814 scopus 로고    scopus 로고
    • note
    • x2 are small, it is important to note that these azulenic systems are isomeric, and multiple approaches (TD-DFT, the B3LYP/6-31G(d,p) HOMO-LUMO gaps, and the HOMO-LUMO gaps of the MP2/6-31(d,p) optimized structures) gave the same trend.
  • 88
    • 18844411806 scopus 로고    scopus 로고
    • note
    • -1.
  • 105
    • 18844446390 scopus 로고    scopus 로고
    • Manuscript in preparation
    • + will be reported elsewhere: Barybin, M. V.; Holovics, T. C. Manuscript in preparation.
    • Barybin, M.V.1    Holovics, T.C.2
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    • +
    • +.


* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.