Gas-phase structure of 2,2,2-trichloroethyl chloroformate studied by electron diffraction and quantum-chemical calculations

Gil DM, Tuttolomondo ME, Blomeyer S, Reuter C, Mitzel NW, Altabef AB (2016)
Phys. Chem. Chem. Phys. 18(1): 393-402.

Zeitschriftenaufsatz | Veröffentlicht | Englisch
 
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Autor*in
Gil, Diego M.; Tuttolomondo, María E.; Blomeyer, SebastianUniBi ; Reuter, ChristianUniBi; Mitzel, Norbert W.UniBi; Altabef, Aída Ben
Erscheinungsjahr
2016
Zeitschriftentitel
Phys. Chem. Chem. Phys.
Band
18
Ausgabe
1
Seite(n)
393-402
ISSN
1463-9076
eISSN
1463-9084
Page URI
https://pub.uni-bielefeld.de/record/2787901

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Gil DM, Tuttolomondo ME, Blomeyer S, Reuter C, Mitzel NW, Altabef AB. Gas-phase structure of 2,2,2-trichloroethyl chloroformate studied by electron diffraction and quantum-chemical calculations. Phys. Chem. Chem. Phys. 2016;18(1):393-402.
Gil, D. M., Tuttolomondo, M. E., Blomeyer, S., Reuter, C., Mitzel, N. W., & Altabef, A. B. (2016). Gas-phase structure of 2,2,2-trichloroethyl chloroformate studied by electron diffraction and quantum-chemical calculations. Phys. Chem. Chem. Phys., 18(1), 393-402. doi:10.1039/c5cp05295e
Gil, Diego M., Tuttolomondo, María E., Blomeyer, Sebastian, Reuter, Christian, Mitzel, Norbert W., and Altabef, Aída Ben. 2016. “Gas-phase structure of 2,2,2-trichloroethyl chloroformate studied by electron diffraction and quantum-chemical calculations”. Phys. Chem. Chem. Phys. 18 (1): 393-402.
Gil, D. M., Tuttolomondo, M. E., Blomeyer, S., Reuter, C., Mitzel, N. W., and Altabef, A. B. (2016). Gas-phase structure of 2,2,2-trichloroethyl chloroformate studied by electron diffraction and quantum-chemical calculations. Phys. Chem. Chem. Phys. 18, 393-402.
Gil, D.M., et al., 2016. Gas-phase structure of 2,2,2-trichloroethyl chloroformate studied by electron diffraction and quantum-chemical calculations. Phys. Chem. Chem. Phys., 18(1), p 393-402.
D.M. Gil, et al., “Gas-phase structure of 2,2,2-trichloroethyl chloroformate studied by electron diffraction and quantum-chemical calculations”, Phys. Chem. Chem. Phys., vol. 18, 2016, pp. 393-402.
Gil, D.M., Tuttolomondo, M.E., Blomeyer, S., Reuter, C., Mitzel, N.W., Altabef, A.B.: Gas-phase structure of 2,2,2-trichloroethyl chloroformate studied by electron diffraction and quantum-chemical calculations. Phys. Chem. Chem. Phys. 18, 393-402 (2016).
Gil, Diego M., Tuttolomondo, María E., Blomeyer, Sebastian, Reuter, Christian, Mitzel, Norbert W., and Altabef, Aída Ben. “Gas-phase structure of 2,2,2-trichloroethyl chloroformate studied by electron diffraction and quantum-chemical calculations”. Phys. Chem. Chem. Phys. 18.1 (2016): 393-402.

46 References

Daten bereitgestellt von Europe PubMed Central.


Windholz, Tetrahedron Lett. 27(), 1967

Montzka, Tetrahedron Lett. 14(), 1974
Total synthesis of apratoxin A.
Doi T, Numajiri Y, Munakata A, Takahashi T., Org. Lett. 8(3), 2006
PMID: 16435877

Itoh, Synlett (), 1999
DFT calculations of structure and vibrational properties of 2,2,2-trichloroethylacetate, CH(3)CO(2)CH(2)CCl(3).
Gil DM, Tuttolomondo ME, Ben Altabef A., Spectrochim Acta A Mol Biomol Spectrosc 123(), 2013
PMID: 24407197

DefonsiLestard, J. Mol. Struct. 917(), 2009

Defonsi, J. Raman Spectrosc. 40(), 2009

DefonsiLestard, Vib. Spectrosc. 65(), 2013

Ulic, Spectrochim. Acta, Part A 54(), 1986

Erben, J. Phys. Chem. A 108(), 2004
Trichloromethyl chloroformate ("diphosgene"), ClCOOCCl3: structure and conformational properties in the gaseous and condensed phases.
Arce VB, Della Vedova CO, Downs AJ, Parsons S, Romano RM., J. Org. Chem. 71(9), 2006
PMID: 16626122

Berger, Z. Naturforsch. 64b(), 2010

Shibata, Rep. Fac. Sci., Shizuoka Univ. 9(), 1974

Vishnevskiy, J. Mol. Struct. 833(), 2007

Frisch, J. Chem. Phys. 80(), 1984

Møller, Phys. Rev. 46(), 1934

Krishnan, J. Chem. Phys. 72(), 1980

McLean, J. Chem. Phys. 72(), 1980

Frisch, J. Chem. Phys. 80(), 1984

Hehre, 1986

Becke, J. Chem. Phys. 98(), 1993
Development of the Colle-Salvetti correlation-energy formula into a functional of the electron density.
Lee C, Yang W, Parr RG., Phys. Rev., B Condens. Matter 37(2), 1988
PMID: 9944570

Alamo, J. Chem. Phys. 108(), 1998
Generalized Gradient Approximation Made Simple.
Perdew JP, Burke K, Ernzerhof M., Phys. Rev. Lett. 77(18), 1996
PMID: 10062328

Perdew, Phys. Rev. Lett. 78(), 1997

Krishnakumar, J. Mol. Struct. 702(), 2004

Glendening, 1996

Bader, 1990

Biegler-Köning, J. Comput. Chem. 22(), 2001
Layered crystal structure, conformational and vibrational properties of 2,2,2-trichloroethoxysulfonamide: an experimental and theoretical study.
Gil DM, Piro OE, Echeverria GA, Tuttolomondo ME, Ben Altabef A., Spectrochim Acta A Mol Biomol Spectrosc 116(), 2013
PMID: 23917382
A conformational and vibrational study of CF(3)COSCH(2)CH(3).
Lestard ME, Tuttolomondo ME, Wann DA, Robertson HE, Rankin DW, Ben Altabef A., J Chem Phys 131(21), 2009
PMID: 19968344
Gas-phase structure, rotational barrier, and vibrational properties of methyl methanethiosulfonate, CH3SO2SCH3: an experimental and computational study.
Tuttolomondo ME, Navarro A, Ruiz TP, Varetti EL, Hayes SA, Wann DA, Robertson HE, Rankin DW, Altabef AB., J Phys Chem A 111(39), 2007
PMID: 17760430
Synthesis, spectroscopic characterization, and conformational properties of trichloromethanesulfenyl acetate, CCl3SOC(O)CH3.
Reina MC, Boese R, Ge M, Ulic SE, Beckers H, Willner H, Della Vedova CO., J Phys Chem A 112(34), 2008
PMID: 18671379

Durig, J. Mol. Spectrosc. 64(), 1977
Vibrational spectral investigations and density functional theory study of 4-Formylbenzoic acid.
Xavier TS, Joe IH, Palafox MA, Kumar S, Rastogi VK., Spectrochim Acta A Mol Biomol Spectrosc 114(), 2013
PMID: 23792290

Bartell, 1975

Mitzel, Dalton Trans. (), 2003
Structure and bonding nature of the strained Lewis acid 3-methyl-1-boraadamantane: a case study employing a new data-analysis procedure in gas electron diffraction.
Vishnevskiy YV, Abaev MA, Rykov AN, Gurskii ME, Belyakov PA, Erdyakov SY, Bubnov YN, Mitzel NW., Chemistry 18(34), 2012
PMID: 22791415

Sipachev, J. Mol. Struct. 121(), 1985

Sipachev, Struct. Chem. 11(), 2000

Sipachev, J. Mol. Struct. 67(), 2001

Sugino, J. Mol. Struct. 245(), 1991

Pyckhout, J. Mol. Struct. 144(), 1986

Erben, J. Phys. Chem. A 108(), 2004
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