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Volumn 37, Issue 1-2, 1998, Pages 177-180

Global and Local Aromaticity in Porphyrins: An Analysis Based on Molecular Geometries and Nucleus-Independent Chemical Shifts

Author keywords

Annulenes; Aromaticity; Density functional calculations; Porphyrinoids

Indexed keywords


EID: 0031930407     PISSN: 14337851     EISSN: None     Source Type: Journal    
DOI: 10.1002/(SICI)1521-3773(19980202)37:1/2<177::AID-ANIE177>3.0.CO;2-H     Document Type: Article
Times cited : (231)

References (31)
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    • c) A. R. Katritzky, P. Barczyñski, G. Musumarra, D. Pisano, M. Szafran, J. Am. Chem. Soc. 1989, 111, 7-15; K. Jug, A. Köster, J. Phys. Org. Chem. 1991, 4, 163-169;
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    • and ref. [1b]
    • d) however, see P. von R. Schleyer, P. K. Freeman, H. Jiao, B. Goldfuss, Angew. Chem. 1995, 107, 332-335; Angew. Chem. Int. Ed. Engl. 1995, 34, 337-340, and ref. [1b];
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    • b) C. W. Bird, Tetrahedron 1985, 41, 1409-1414;
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    • b) G. Subramanian, P. von R. Schleyer, H. Jiao, Angew. Chem. 1996, 108, 2824-2827; Angew. Chem. Int. Ed. Engl. 1996, 35, 2638-2641.
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  • 20
    • 0001663911 scopus 로고    scopus 로고
    • and references therein
    • See, for example, E. Vogel, J. Heterocycl. Chem. 1996, 33, 1461-1487 and references therein.
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    • 0030598025 scopus 로고    scopus 로고
    • b) ibid. 1996, 52, 10255-10264.
    • (1996) Tetrahedron , vol.52 , pp. 10255-10264
  • 24
    • 0348025011 scopus 로고    scopus 로고
    • note
    • In the Cambridge Structural Database. AS refers to the precision of the crystal structure determination. For example, "AS = 1, 2" means that the mean estimated standard deviation for the bond lengths does not exceed 0.01 Å.
  • 27
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    • b) T. M. Krygowski, R. Anulewicz, M. Wisiorowski, Pol. J. Chem. 1995, 69, 1579-1584. The HOSE model permits the estimation of the canonical structure weights directly from the bond lengths of the molecule containing π electrons or its fragment.
    • (1995) Pol. J. Chem. , vol.69 , pp. 1579-1584
    • Krygowski, T.M.1    Anulewicz, R.2    Wisiorowski, M.3
  • 30
    • 0030593012 scopus 로고    scopus 로고
    • and references therein
    • For further calculations on the porphyrin system, see a) D. Lamoen, M. Parinello, Chem. Phys. Lett. 1996, 248, 309-315 and references therein; b) P. M. Kozlowski, A. A. Jarzecki, P. Pulay, J. Phys. Chem. 1996, 100, 7007-7013 and references therein.
    • (1996) Chem. Phys. Lett. , vol.248 , pp. 309-315
    • Lamoen, D.1    Parinello, M.2
  • 31
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    • and references therein
    • For further calculations on the porphyrin system, see a) D. Lamoen, M. Parinello, Chem. Phys. Lett. 1996, 248, 309-315 and references therein; b) P. M. Kozlowski, A. A. Jarzecki, P. Pulay, J. Phys. Chem. 1996, 100, 7007-7013 and references therein.
    • (1996) J. Phys. Chem. , vol.100 , pp. 7007-7013
    • Kozlowski, P.M.1    Jarzecki, A.A.2    Pulay, P.3


* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.