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Volumn 118, Issue 1, 1996, Pages 243-244

Electronic coupling in C-clamp-shaped molecules: Solvent-mediated superexchange pathways

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[No Author keywords available]

Indexed keywords


EID: 0001409808     PISSN: 00027863     EISSN: None     Source Type: Journal    
DOI: 10.1021/ja952999+     Document Type: Article
Times cited : (109)

References (67)
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    • For previous eT studies of DSAs in which through-solvent coupling has been implicated, see: (a) Oliver, A. M.; Craig, D. C.; Paddon-Row, M. N : Kroon, J.; Verhoeven. J. W. Chem. Phys. Lett. 1988, 150, 366. (b) Liu, J.-y.; Schmidt, J. A.; Bolton, J. R. J. Phys. Chem. 1991, 95, 6924. (c) Lawson, J. M., et al. J. Phys. Chem. 1993, 97, 13099. (d) Sakata, Y.; et al. J. Am. Chem. Soc. 1994, 116, 6904.
    • (1988) Chem. Phys. Lett. , vol.150 , pp. 366
    • Oliver, A.M.1    Craig, D.C.2    Paddon-Row, M.N.3    Kroon, J.4    Verhoeven, J.W.5
  • 24
    • 0001320889 scopus 로고
    • For previous eT studies of DSAs in which through-solvent coupling has been implicated, see: (a) Oliver, A. M.; Craig, D. C.; Paddon-Row, M. N : Kroon, J.; Verhoeven. J. W. Chem. Phys. Lett. 1988, 150, 366. (b) Liu, J.-y.; Schmidt, J. A.; Bolton, J. R. J. Phys. Chem. 1991, 95, 6924. (c) Lawson, J. M., et al. J. Phys. Chem. 1993, 97, 13099. (d) Sakata, Y.; et al. J. Am. Chem. Soc. 1994, 116, 6904.
    • (1991) J. Phys. Chem. , vol.95 , pp. 6924
    • Liu, J.-Y.1    Schmidt, J.A.2    Bolton, J.R.3
  • 25
    • 0000703203 scopus 로고
    • For previous eT studies of DSAs in which through-solvent coupling has been implicated, see: (a) Oliver, A. M.; Craig, D. C.; Paddon-Row, M. N : Kroon, J.; Verhoeven. J. W. Chem. Phys. Lett. 1988, 150, 366. (b) Liu, J.-y.; Schmidt, J. A.; Bolton, J. R. J. Phys. Chem. 1991, 95, 6924. (c) Lawson, J. M., et al. J. Phys. Chem. 1993, 97, 13099. (d) Sakata, Y.; et al. J. Am. Chem. Soc. 1994, 116, 6904.
    • (1993) J. Phys. Chem. , vol.97 , pp. 13099
    • Lawson, J.M.1
  • 26
    • 0001446754 scopus 로고
    • For previous eT studies of DSAs in which through-solvent coupling has been implicated, see: (a) Oliver, A. M.; Craig, D. C.; Paddon-Row, M. N : Kroon, J.; Verhoeven. J. W. Chem. Phys. Lett. 1988, 150, 366. (b) Liu, J.-y.; Schmidt, J. A.; Bolton, J. R. J. Phys. Chem. 1991, 95, 6924. (c) Lawson, J. M., et al. J. Phys. Chem. 1993, 97, 13099. (d) Sakata, Y.; et al. J. Am. Chem. Soc. 1994, 116, 6904.
    • (1994) J. Am. Chem. Soc. , vol.116 , pp. 6904
    • Sakata, Y.1
  • 40
    • 85033864177 scopus 로고    scopus 로고
    • note
    • -A. where S is solvent or spacer.
  • 41
    • 85033840653 scopus 로고    scopus 로고
    • note
    • 6e
  • 45
    • 85033845877 scopus 로고    scopus 로고
    • note
    • 15
  • 46
    • 85033849064 scopus 로고    scopus 로고
    • note
    • s(295 K) are listed in Table 1.
  • 49
    • 85033851536 scopus 로고    scopus 로고
    • note
    • (a) The H atoms directed toward the clamp interior on C2, C5, and CS of the bridge (anthracenonorbornene bridgehead is C1) are separated by 1.95 and 2.03 Å, pairwise respectively,
  • 50
    • 85033855736 scopus 로고
    • CAChe Scientific
    • (b) Distances, energies, and geometry optimizations performed using the MM2 force field implemented in CAChe Mechanics, Version 3.6. CAChe Scientific, 1994.
    • (1994) CAChe Mechanics, Version 3.6
  • 52
    • 85033857949 scopus 로고    scopus 로고
    • note
    • 15 |V|'s are not scaled. The corresponding "experimental" |V| at this geometry is not known.
  • 54
    • 85033835453 scopus 로고    scopus 로고
    • note
    • 14b
  • 55
    • 85033838950 scopus 로고
    • CAChe Scientific.
    • 19b LUMO energies are 0.66, 1.67, and 1.66 eV for PhCN. MeCN, and DMA, respectively (MOPAC Version 94.1 in CAChe, Version 3.6. CAChe Scientific. 1994).
    • (1994) MOPAC Version 94.1 in CAChe, Version 3.6
  • 60
    • 85033839188 scopus 로고    scopus 로고
    • note
    • +) ].
  • 61
    • 85033849588 scopus 로고    scopus 로고
    • note
    • -)A mediating state energy for 4 in the higher refractive index solvent, PhCN, will be lower. The eT activation energy for 4 in PhCN is 0.06 eV.
  • 65
    • 85033862712 scopus 로고    scopus 로고
    • note
    • The solvent dependence of |V| in DSA 3 suggests some contribution of solvent-mediated couplina.


* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.