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Volumn 109, Issue 26, 2005, Pages 12891-12898

Electronic structures and charge transport properties of the organic semiconductor bis[1,2,5]thiadiazolo-p-quinobis(1,3-dithiole), BTQBT, and its derivatives

Author keywords

[No Author keywords available]

Indexed keywords

DELOCALIZATION; FIELD-EFFECT MOBILITY; INTERMOLECULAR PACKING; MOLECULAR STRUCTURES;

EID: 22344444525     PISSN: 15206106     EISSN: None     Source Type: Journal    
DOI: 10.1021/jp0513869     Document Type: Article
Times cited : (22)

References (93)
  • 19
    • 22444449308 scopus 로고    scopus 로고
    • note
    • For brevity, we use acronyms of these materials throughout the work: 4,8-bis( 1,3-dithiol-2-ylidene)-4H,8H-benzo[1,2-c:4,5-c′]bis[1,2,5]- thiadiazole (BTQBT); 4,8-bis(1,3-dithiol-2-ylidene)-4H,8H-[1,2, 5]selenadiazolo[3,4-f]-2,1,3-benzothiadiazole (TSQBT); 4,8-bis(1,3-diselenol-2- ylidene)-4H,8H-benzo[1,2-c:4,5-c′]bis[1,2,5]thiadiazole (BTQBS); tetramethyl-BTQBT (TMBTQBT).
  • 21
    • 1842502860 scopus 로고    scopus 로고
    • Generally, two types of packing motives featuring π-π overlap can be observed: herringbone (also called edge-to-face) motif, for example, that of pentacene, and π-stack (also called face-to-face) motif. See Curtis, M. D.; Cao, J.; Kampf, J. W. J. Am. Chem. Soc. 2004, 126, 4318.
    • (2004) J. Am. Chem. Soc. , vol.126 , pp. 4318
    • Curtis, M.D.1    Cao, J.2    Kampf, J.W.3
  • 39
    • 2342567054 scopus 로고    scopus 로고
    • The term "model chemistry" has been used by J. A. Pople to identify a particular level of theory and basis set for identification and comparison purpose. See studies of model chemistry dependence of transfer integrals: (a) Huang, J. S.; Kertesz, M. Chem. Phys. Lett. 2004, 390, 110.
    • (2004) Chem. Phys. Lett. , vol.390 , pp. 110
    • Huang, J.S.1    Kertesz, M.2
  • 56
    • 22444438057 scopus 로고    scopus 로고
    • note
    • 201, which is 3.292 Å, not with intermolecular separation of 3.465 Å along c.
  • 63
    • 22444447146 scopus 로고    scopus 로고
    • note
    • A (001) dimer excised from the single crystal of BTQBT was calculated to obtain transfer integrals from the dimer level splittings. (calculated by the software Hyperchem.)
  • 64
    • 22444431994 scopus 로고    scopus 로고
    • note
    • This issue is further discussed in the Supporting Information section.
  • 68
    • 0037435228 scopus 로고    scopus 로고
    • Karl, N. Synth. Met. 2003, 133-134, 649.
    • (2003) Synth. Met. , vol.133-134 , pp. 649
    • Karl, N.1


* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.