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  • 11
    Electronic Resource
    Electronic Resource
    Weinheim : Wiley-Blackwell
    Berichte der deutschen chemischen Gesellschaft 130 (1997), S. 131-134 
    ISSN: 0009-2940
    Keywords: Trifluoromethyl vinyl sulfide ; Gas-phase structure ; Electron diffraction ; Chemistry ; Inorganic Chemistry
    Source: Wiley InterScience Backfile Collection 1832-2000
    Topics: Chemistry and Pharmacology
    Notes: The geometric structure of trifluoromethyl vinyl sulfide, CF3SC(H)=CH2, was determined by gas electron diffraction and ab initio calculations (HF/3-21G* and MP2/6-31G*). A single conformer with a dihedral angle φ(C=C-S-C) = 129(4)° is present. The conformational properties are compared to those of the parent compound, CH3SC(H)=CH2, and of the perfluorinated species CF3SC(F)=CF2.
    Additional Material: 3 Ill.
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  • 12
    Electronic Resource
    Electronic Resource
    Weinheim : Wiley-Blackwell
    Berichte der deutschen chemischen Gesellschaft 123 (1990), S. 2117-2122 
    ISSN: 0009-2940
    Keywords: 1λ4,3λ4,5λ4-Trithiatriazines ; Anomeric effect ; Antiaromaticity ; Calculations, ab initio, MNDO ; Chemistry ; Inorganic Chemistry
    Source: Wiley InterScience Backfile Collection 1832-2000
    Topics: Chemistry and Pharmacology
    Notes: The Structure of TrithiatriazinesMNDO and ab initio calculations have shown that the structure of trithiatriazines [(RSN)3, where R = F, Cl, {H}] is influenced by the anomeric effect and by antiaromaticity of the ring for electron pairs in axial positions. These calculations are supported by a joint electron diffraction and microwave structure determination of (NSF)3 in the gas phase.
    Additional Material: 2 Ill.
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  • 13
    Electronic Resource
    Electronic Resource
    Weinheim : Wiley-Blackwell
    Berichte der deutschen chemischen Gesellschaft 126 (1993), S. 665-668 
    ISSN: 0009-2940
    Keywords: 2-Isotetrasilanylsodium salt ; Trisilylgermyl(alkali metal) salt ; 2-Methylisotetrasilane ; Methyltrisilylgermane ; Electron diffraction ; Chemistry ; Inorganic Chemistry
    Source: Wiley InterScience Backfile Collection 1832-2000
    Topics: Chemistry and Pharmacology
    Notes: Synthesis and Molecular Structure of CH3M(SiH3)3 (M=Si, Ge)A solution of 2-isotetrasilanylsodium (1a) was obtained in good yield from silane and sodium under special conditions. Methylation of 1a with methyl p1-toluenesulfonate yields 2-methylisotetrasilane (1b). The corresponding methyltrisilylgermane (2b) was synthesized via (K, Cs)Ge(SiH3)3 (2a) resulting from the reaction of cesium trichlorogermanide with KSiH3 followed by methylation. The molecular structures of 1a and 1b were determined by electron diffraction analyses.
    Additional Material: 3 Ill.
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  • 14
    Electronic Resource
    Electronic Resource
    Weinheim : Wiley-Blackwell
    Berichte der deutschen chemischen Gesellschaft 129 (1996), S. 653-656 
    ISSN: 0009-2940
    Keywords: Hydroxylamine, O-methyl-N,N-bis(trifluoromethyl)-, gas-phase structure of ; Electron diffraction ; Calculations, ab initio ; Chemistry ; Inorganic Chemistry
    Source: Wiley InterScience Backfile Collection 1832-2000
    Topics: Chemistry and Pharmacology
    Notes: The molecular structure of (CF3)2NOCH3 was determined by gas electron diffraction. The molecular intensities were reproduced by use of a single conformation with syn orientation of the O-CH3 group relative to the nitrogen lone pair. This was confirmed by ab initio calculations (HF/3-21G(*), polarization functions only on nitrogen, and MP2/6-31G*). The observed structure demonstrates that the generalized anomeric effect is of minor importance to this compound. The following skeletal geometric parameters (bond lengths [pm] and angles [°] with 3-s̰ uncertainties) were derived: N-C 142.9(7), N-O 142(3), O-C 145(3), CNC 118.0(9), CNO 108.1(17), and NOC 109.4(17). The experimental structure is well reproduced by the ab initio calculations.
    Additional Material: 3 Ill.
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  • 15
    Electronic Resource
    Electronic Resource
    Weinheim : Wiley-Blackwell
    Zeitschrift für anorganische Chemie 620 (1994), S. 822-826 
    ISSN: 0044-2313
    Keywords: Bis(fluorosulfonyl)difluoromethane ; gas-phase structure ; conformation ; Chemistry ; Inorganic Chemistry
    Source: Wiley InterScience Backfile Collection 1832-2000
    Topics: Chemistry and Pharmacology
    Description / Table of Contents: Die Gasphasen-Struktur von Bis(fluorosulfonyl)difluormethan, (SO2F)2CF2Es wird über neue Syntheseverfahren und das Infrarotspektrum von Bis(fluorsulfonyl) Difluormethan, (SO2F)2CF2 berichtet. Die geometrische Struktur und die Konformationseigenschaften dieser Verbindung wurden mittels der Elektronenbeugung an Gasen untersucht. Je nach Stellung der zwei SO2F Gruppen können vier Konformere mit unterschiedlichen Symmetrien auftreten: C2v Symmetrie, falls beide S—F Bindungen auf Lücke zu CF2 stehen, C2 oder Cs Symmetrie, falls eine S=O Bindung jeder SO2F Gruppe auf Lücke zu CF2 steht und C1 Symmetrie, falls eine S—F und eine S=O Bindung auf Lücke zu CF2 stehen. Die experimentellen Elektronenbeugungsintensitäten können mit einem C1 Konformeren oder mit einem Gemisch aus C2v, C2 und Cs Konformeren im Verhältnis 3:2:5 nahezu gleich gut angepaßt werden. Die folgenden geometrischen Parameter (ra Abstände und ∠α Winkel mit 3σ Fehlergrenzen) wurden erhalten: C—F = 1,340(6) Å, S=O = 1,412(2) Å, S—F = 1,550(3) Å, C—S = 1,848(4) Å, S—C—S = 113,6(7)°, F—C—F = 110,0(10)°, O=S=O = 124,6(18)°, C—S—F = 96,5(16)° und C—S=O = 108,4(14)°.
    Notes: New synthetic pathways and the infrared spectrum of bis(fluorosulfonyl)difluoromethane, (SO2F)2CF2, are reported. The geometric structure and conformational properties of the title compound have been studied by gas electron diffraction. Depending on the rotational position of the two SO2F groups, four conformers with different symmetries can occur in this compound: C2v symmetry, if both S—F bonds stagger the CF2 group. C2 or Cs symmetry, if one S=O bond of each group staggers the CF2 group. The experimental electron diffraction intensities can be fitted equally well with a C1 conformer or with a mixture of C2v, C2 and Cs conformers, in a ratio of 3:2:5. The following geometric parameters (ra distances, ∠α angles with 3σ uncertainties) were derived: C—F = 1.340(6) Å, S=O = 1.412(2) Å, S—F = 1.550(3) Å, C—S = 1.848(4) Å, S—C—S = 113.6(7)°, F—C—F = 110.0(10)°, O=S=O = 124.6(18)°, C—S—F = 96.5(16)° and C—S=O = 108.4(14)°.
    Additional Material: 2 Ill.
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  • 16
    Electronic Resource
    Electronic Resource
    Weinheim : Wiley-Blackwell
    Zeitschrift für anorganische Chemie 621 (1995), S. 1849-1855 
    ISSN: 0044-2313
    Keywords: Trifluoroethylene Sultone ; 3,4,4-Trifluoro-1,2-oxathietane-2,2-dioxide ; Gas Electron Diffraction ; Structure ; Chemistry ; Inorganic Chemistry
    Source: Wiley InterScience Backfile Collection 1832-2000
    Topics: Chemistry and Pharmacology
    Description / Table of Contents: Trifluorethylensulton: Struktur und ChemieDie Struktur des Trifluorethylensultons (1) (3,4,4-Trifluor-1,2-oxathietan-2,2-dioxid) wurde durch Elektronenbeugung in der Gasphase bestimmt. Der viergliedrige Ring ist planar. Folgende Parameter (ra Abstände und ∠α-Winkel mit der Fehlergrenze von 3σ) wurden erhalten: C—O = 1,41 Å (ass), C—C = 1,541(18) Å, S—O = 1,652(5) Å, S—C = 1,822(8) Å, S—C—C = 86,2(15)°, C—C—O = 97,1(28)°, C—O—S = 97,5(21)° und O—S—C = 79,1(8)°. Neue spektroskopische Daten (IR, NMR) für 1, sein acyclisches Isomer FSO2CFHC(O)F (2), und das Anhydrid FSO2OSO2CFHC(O)F (3) werden mitgeteilt. Neue Ester mit der Fluorsulfonyl-Funktion, FSO2CFHC(O)OCH2CF3 (4), FSO2CFHC(O)OCH2CH = CH2 (5), und (FSO2CFHC(O)OCH2CH—CH2—)n (6) wurden dargestellt und charakterisiert.
    Notes: The gas phase structure of trifluoroethylene sultone, (1) (3,4,4-trifluoro-1,2-oxathietane-2,2-dioxide) was determined by gas electron diffraction, and the four-membered ring was found to be planar. The following ring parameters (ra distances and ∠α angles with 3σ uncertainties) were derived in the electron diffraction analysis: C—O = 1.41 Å (ass.), C—C = 1.541(18) Å, S—O = 1.652(5) Å, S—C = 1.822(8) Å, S—C—C = 86.2(15)°, C—C—O = 97.1(28)°, C—O—S = 97.5(21)°, and O—S—C = 79.1(8)°. New spectral data (IR, NMR) of 1, its acyclic isomer FSO2CFHC(O)F (2), and the related anhydride, FSO2OSO2CFHC(O)F (3), are reported. New esters containing the fluorosulfonyl function, FSO2CFHC(O)OCH2CF3 (4), FSO2CFHC(O)OCH2CH = CH2 (5), and (FSO2CFHC(O)OCH2CH—CH2—)n (6) have been prepared and characterized.
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  • 17
    Electronic Resource
    Electronic Resource
    Weinheim : Wiley-Blackwell
    Angewandte Chemie International Edition in English 36 (1997), S. 1518-1519 
    ISSN: 0570-0833
    Keywords: electron diffraction ; fluorine ; nitrogen ; structure ; elucidation ; Chemistry ; General Chemistry
    Source: Wiley InterScience Backfile Collection 1832-2000
    Topics: Chemistry and Pharmacology
    Additional Material: 2 Ill.
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  • 18
    ISSN: 0570-0833
    Keywords: electron diffraction ; oxygen compounds ; structure elucidation ; trioxides ; Chemistry ; General Chemistry
    Source: Wiley InterScience Backfile Collection 1832-2000
    Topics: Chemistry and Pharmacology
    Additional Material: 2 Ill.
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