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Volumn 12, Issue 13, 2010, Pages 2912-2915

Absolute configuration assignment of inherently chiral calix[4]arenes using DFT calculations of chiroptical properties

Author keywords

[No Author keywords available]

Indexed keywords

CALIX(4)ARENE; CALIXARENE; PHENOL DERIVATIVE;

EID: 77954139760     PISSN: 15237060     EISSN: 15237052     Source Type: Journal    
DOI: 10.1021/ol101098x     Document Type: Article
Times cited : (35)

References (44)
  • 1
    • 33748539998 scopus 로고
    • For comprehensive reviews on calixarenes, see
    • For comprehensive reviews on calixarenes, see: Böhmer, V. Angew. Chem., Int. Ed. Engl. 1995, 34, 713
    • (1995) Angew. Chem., Int. Ed. Engl. , vol.34 , pp. 713
    • Böhmer, V.1
  • 3
  • 4
    • 0003773224 scopus 로고    scopus 로고
    • 2001, Asfari, Z.; Böhmer, V.; Harrowfield, J.; Vicens, J., Eds.; Kluwer: Dordrecht
    • Calixarenes 2001; Asfari, Z.; Böhmer, V.; Harrowfield, J.; Vicens, J., Eds.; Kluwer: Dordrecht, 2001.
    • (2001) Calixarenes
  • 5
    • 77954110875 scopus 로고    scopus 로고
    • For reviews on inherently chiral calixarenes, see
    • For reviews on inherently chiral calixarenes, see
  • 9
    • 77954127454 scopus 로고    scopus 로고
    • For typical representative examples, see
    • For typical representative examples, see
  • 20
    • 77954110093 scopus 로고    scopus 로고
    • For typical examples of enantioselective HPLC resolution of inherently chiral calixarenes, see ref 2 in the Supporting Information
    • For typical examples of enantioselective HPLC resolution of inherently chiral calixarenes, see ref 2 in the Supporting Information.
  • 26
    • 0003546549 scopus 로고    scopus 로고
    • For comprehensive articles on ECD, see: Berova, N.; Nakanishi, K.; Woody, R. W., Eds.; Wiley-VCH: New York
    • For comprehensive articles on ECD, see: Circular Dichroism, Principles and Applications; Berova, N.; Nakanishi, K.; Woody, R. W., Eds.; Wiley-VCH: New York, 2000.
    • (2000) Circular Dichroism, Principles and Applications
  • 27
    • 77954133797 scopus 로고    scopus 로고
    • Notwithstanding the special interest for the inherent chirality of meta-substituted calix[4]arenes, functionalizations at the meta position of calixarene aromatic rings are relatively uncommon. For some representative examples, see
    • Notwithstanding the special interest for the inherent chirality of meta-substituted calix[4]arenes, functionalizations at the meta position of calixarene aromatic rings are relatively uncommon. For some representative examples, see
  • 34
    • 77954095381 scopus 로고    scopus 로고
    • See the Supporting Information for further details
    • See the Supporting Information for further details.
  • 36
    • 0038762733 scopus 로고    scopus 로고
    • Wavefunction, Inc., Irvine, CA
    • Spartan 02; Wavefunction, Inc., Irvine, CA.
    • Spartan 02
  • 37
    • 77954133238 scopus 로고    scopus 로고
    • Frisch et al. Gaussian 03, Gaussian, Inc., Pittsburgh, PA, 2003
    • Frisch et al. Gaussian 03, Gaussian, Inc., Pittsburgh, PA, 2003.
  • 41
    • 77954105758 scopus 로고    scopus 로고
    • The cc-PVDZ(d) basis set has been obtained from the smaller cc-PVDZ basis set by adding a single set of d functions to heavy atoms. The exponents of these diffuse functions are those of the most diffuse d functions of the standard aug-cc-PVDZ basis set
    • The cc-PVDZ(d) basis set has been obtained from the smaller cc-PVDZ basis set by adding a single set of d functions to heavy atoms. The exponents of these diffuse functions are those of the most diffuse d functions of the standard aug-cc-PVDZ basis set.
  • 42
    • 77954122237 scopus 로고    scopus 로고
    • Usually, ab initio assignments are considered to be reliable if the OR magnitude is higher than 28.9
    • Usually, ab initio assignments are considered to be reliable if the OR magnitude is higher than 28.9


* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.