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Volumn 11, Issue 20, 2005, Pages 5975-5987

Gas-phase dehydrogenation of methanol with mononuclear vanadium-oxide cations

Author keywords

Mass spectrometry; Metal alkoxides; Methanol; Oxidation; Vanadium

Indexed keywords

CONDENSATION; CYCLOTRON RESONANCE; DEHYDROGENATION; FOURIER TRANSFORMS; MASS SPECTROMETRY; OXIDATION; POSITIVE IONS; VANADIUM; VANADIUM COMPOUNDS;

EID: 26844569882     PISSN: 09476539     EISSN: None     Source Type: Journal    
DOI: 10.1002/chem.200401352     Document Type: Article
Times cited : (53)

References (93)
  • 3
    • 26844552305 scopus 로고    scopus 로고
    • the entire volume
    • Appl. Catal. A 1997, 157 (the entire volume).
    • (1997) Appl. Catal. A , vol.157
  • 14
    • 0346094026 scopus 로고    scopus 로고
    • Angew. Chem. Int. Ed. 2003, 42, 5932-5954.
    • (2003) Angew. Chem. Int. Ed. , vol.42 , pp. 5932-5954
  • 20
    • 18144378483 scopus 로고    scopus 로고
    • and references therein
    • Angew. Chem. Int. Ed. 2005, 44, 2336-2354, and references therein.
    • (2005) Angew. Chem. Int. Ed. , vol.44 , pp. 2336-2354
  • 22
  • 24
    • 26844456998 scopus 로고    scopus 로고
    • Structure, dynamics and reactivity of transition-metal oxide aggregates
    • Sonderforschungsbereich 546. Structure, dynamics and reactivity of transition-metal oxide aggregates, http://www.chemie.hu-berlin.de/sfb546/index. html
    • Sonderforschungsbereich , vol.546
  • 27
    • 26844478145 scopus 로고    scopus 로고
    • D. Schröder, M. Engeser, H. Schwarz, E. C. E. Rosenthal, J. Doebler, J. Sauer, unpublished results
    • D. Schröder, M. Engeser, H. Schwarz, E. C. E. Rosenthal, J. Doebler, J. Sauer, unpublished results.
  • 36
  • 40
    • 0004133516 scopus 로고    scopus 로고
    • Gaussian, Inc., Pittsburgh PA (USA)
    • Gaussian 98, Revision A.7, Gaussian, Inc., Pittsburgh PA (USA), 1998.
    • (1998) Gaussian 98, Revision A.7
  • 49
    • 36549091598 scopus 로고
    • b) T. Su, J. Chem. Phys. 1988, 88, 4102-4103;
    • (1988) J. Chem. Phys. , vol.88 , pp. 4102-4103
    • Su, T.1
  • 50
    • 0000834277 scopus 로고
    • T. Su, J. Chem. Phys. 1988, 59, 5355-5356.
    • (1988) J. Chem. Phys. , vol.59 , pp. 5355-5356
    • Su, T.1
  • 52
    • 26844511088 scopus 로고    scopus 로고
    • note
    • -1.
  • 53
    • 26844463748 scopus 로고    scopus 로고
    • note
    • -1.
  • 59
    • 4344628908 scopus 로고    scopus 로고
    • and references therein
    • b) H. Schwarz, Int. J. Mass Spectrom. 2004, 237, 75-105, and references therein.
    • (2004) Int. J. Mass Spectrom. , vol.237 , pp. 75-105
    • Schwarz, H.1
  • 65
    • 0033801033 scopus 로고    scopus 로고
    • Foreword
    • W. L. Hase, W. Koch, Int. J. Mass Spectrom. 2000, 207, ix-x (Foreword); the whole issue deals with theoretical/computational studies of ionic systems and the impact of computational chemistry of the structures, energetics, and kinetics of gas-phase ions.
    • (2000) Int. J. Mass Spectrom. , vol.207
    • Hase, W.L.1    Koch, W.2
  • 70
    • 0141619411 scopus 로고    scopus 로고
    • Angew. Chem. Int. Ed. 2003, 42, 4442-4454;
    • (2003) Angew. Chem. Int. Ed. , vol.42 , pp. 4442-4454
  • 78
    • 26844433822 scopus 로고    scopus 로고
    • note
    • -1 (taken from ref. [59]).
  • 79
    • 26844473268 scopus 로고    scopus 로고
    • note
    • + of path i-b). As discussed there, this intermediate is a dead end for methanol dehydrogenation without any viable way to the experimentally observed exit channel.
  • 80
    • 26844509060 scopus 로고    scopus 로고
    • note
    • This has been verified by intrinsic reaction coordinate (IRC) calculations for the triplet surface.
  • 81
    • 26844505701 scopus 로고    scopus 로고
    • note
    • -1 above the triplet species at the B3LYP/Lanl2DZ-level.
  • 84
    • 26844435543 scopus 로고    scopus 로고
    • note
    • Note that mere association reactions are disfavored under the low-pressure ICR conditions, but the probability rises with increasing size of the system.
  • 85
    • 26844490331 scopus 로고    scopus 로고
    • note
    • Due to low abundances (<5%), ions with m/z 129 and 143 are not included in Figure 6 for the sake of clarity.
  • 86
    • 26844467128 scopus 로고    scopus 로고
    • note
    • -1 (refs. [21] and [40]).
  • 87
    • 26844471932 scopus 로고    scopus 로고
    • note
    • II.


* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.