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Volumn 50, Issue 27, 2011, Pages 6105-6108

Ab initio powder diffraction structure analysis of a host-guest network: Short contacts between tetrathiafulvalene molecules in a pore

Author keywords

charge transfer; coordination networks; host guest systems; tetrathiafulvalene; X ray diffraction

Indexed keywords

AB INITIO; COORDINATION NETWORKS; HOST-GUEST SYSTEM; HOST-GUESTS; LARGE UNIT CELL; POWDER DIFFRACTION; SHORT CONTACTS; SYNCHROTRON POWDER XRD; TETRATHIAFULVALENES;

EID: 79959494878     PISSN: 14337851     EISSN: 15213773     Source Type: Journal    
DOI: 10.1002/anie.201100176     Document Type: Article
Times cited : (35)

References (55)
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    • PoreA is roughly cylindrical and is mainly surrounded by the hydrogen atoms of an infinite aromatic stacking of TPT and triphenylene. PoreB is trigonal-prismatic and is surrounded by three walls: two of them are π faces of ligand TPT and the third corresponds to the edges of TPT and triphenylene. Detailed description of network 3
    • PoreA is roughly cylindrical and is mainly surrounded by the hydrogen atoms of an infinite aromatic stacking of TPT and triphenylene. PoreB is trigonal-prismatic and is surrounded by three walls: two of them are π faces of ligand TPT and the third corresponds to the edges of TPT and triphenylene. Detailed description of network 3:, O. Ohmori, M. Kawano, M. Fujita, Angew. Chem. 2005, 117, 1998-2000
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    • 2 in methanol on a solution of TPT and triphenylene in methanol/nitrobenzene (same starting materials, molar ratio, and solvent as used for kinetic product) yields large single crystals (after one week) of different 1D chain network 5 as a thermodynamically controlled product (FigureS5, Supporting Information), in which triphenylene molecules are also sandwiched between TPT molecules through CT interactions along the b axis, like in networks 3 and 4. However, the thermodynamic product 5 never encapsulates TTF even after immersing it in cyclohexane/TTF solution (20mL/12.26mg, 0.06mmol) for a week
    • 2 in methanol on a solution of TPT and triphenylene in methanol/nitrobenzene (same starting materials, molar ratio, and solvent as used for kinetic product) yields large single crystals (after one week) of different 1D chain network 5 as a thermodynamically controlled product (FigureS5, Supporting Information), in which triphenylene molecules are also sandwiched between TPT molecules through CT interactions along the b axis, like in networks 3 and 4. However, the thermodynamic product 5 never encapsulates TTF even after immersing it in cyclohexane/TTF solution (20mL/12.26mg, 0.06mmol) for a week.
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    • 2] in which rotation about the Zn-N bond is allowed, triphenylene, two TTF molecules, and cyclohexane were used as rigid groups in the asymmetric unit. For details, see Experimental Section
    • 2] in which rotation about the Zn-N bond is allowed, triphenylene, two TTF molecules, and cyclohexane were used as rigid groups in the asymmetric unit. For details, see Experimental Section.
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* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.