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  • Articles  (60)
  • Inorganic Chemistry  (29)
  • Organic Chemistry  (28)
  • Atomic, Molecular and Optical Physics  (3)
  • 42.75
  • Surface physics, nanoscale physics, low-dimensional systems
  • 1970-1974  (34)
  • 1915-1919  (26)
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  • Articles  (60)
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  • 1
    Electronic Resource
    Electronic Resource
    Padé approximants to physical properties via inner projections (1973)
    New York, NY : Wiley-Blackwell
    International Journal of Quantum Chemistry 7 (1973), S. 133-134 
    Details
    ISSN: 0020-7608
    Keywords: Computational Chemistry and Molecular Modeling ; Atomic, Molecular and Optical Physics
    Source: Wiley InterScience Backfile Collection 1832-2000
    Topics: Chemistry and Pharmacology
    Type of Medium: Electronic Resource
    URL: http://dx.doi.org/10.1002/qua.560070114
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  • 2
    Electronic Resource
    Electronic Resource
    Molecular-orbital calculations on transition metal complexes, charge-transfer spectra and the sequence of metal and ligand orbitals (1972)
    New York, NY : Wiley-Blackwell
    International Journal of Quantum Chemistry 6 (1972), S. 859-880 
    Details
    ISSN: 0020-7608
    Keywords: Computational Chemistry and Molecular Modeling ; Atomic, Molecular and Optical Physics
    Source: Wiley InterScience Backfile Collection 1832-2000
    Topics: Chemistry and Pharmacology
    Notes: An outline is given of a semi-empirical scheme for molecular-orbital calculations on transition-metal complexes according to a revised INDO procedure. To judge the reliability of the results of the calculations, the charge-transfer transitions of a number of complexes have been calculated and compared with experimental data. Both for the excitation energies and for the oscillator strengths the agreement is very satisfactory. With respect to the sequence of occupied metal and ligand orbitals it was found that for closed-shell d6 and d8 systems the molecular orbitals which are mainly composed of metal d orbitals have a lower energy than the orbitals built up from ligand p orbitals. Calculations by the extended Hückel method and other similar schemes give the d orbitals as the highest occupied ones as a result of a bad approximation of the diagonal elements of the Fock matrix. The consequences for the interpretation of photo-electron spectra of transition-metal complexes are discussed.
    Additional Material: 3 Ill.
    Type of Medium: Electronic Resource
    URL: http://dx.doi.org/10.1002/qua.560060506
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  • 3
    Electronic Resource
    Electronic Resource
    Molecular integrals over generalized gaussian basis sets (1974)
    New York, NY : Wiley-Blackwell
    International Journal of Quantum Chemistry 8 (1974), S. 179-191 
    Details
    ISSN: 0020-7608
    Keywords: Computational Chemistry and Molecular Modeling ; Atomic, Molecular and Optical Physics
    Source: Wiley InterScience Backfile Collection 1832-2000
    Topics: Chemistry and Pharmacology
    Notes: A method is given for obtaining the common molecular integrals over generalized gaussian functions: \documentclass{article}\pagestyle{empty}\begin{document}$$ \chi_i = x^{\lambda_i}_i \exp \big\{ - \big(\alpha_i x^2_i + \alpha^{\prime}_i x^{\prime 2}_i + \alpha^{\prime\prime}_i x^{\prime\prime 2}_i\big)\big\} $$\end{document}The present algorithms are expected to be more efficient than those given in earlier work by the same author.
    Type of Medium: Electronic Resource
    URL: http://dx.doi.org/10.1002/qua.560080205
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  • 4
    Electronic Resource
    Electronic Resource
    Über das Vorkommen von SelenwasserstoffIst in gleicher Form ein Bestandteil des Eises. im Regen und im Schnee (1918)
    New York, NY : Wiley-Blackwell
    Helvetica Chimica Acta 1 (1918), S. 52-54 
    Details
    ISSN: 0018-019X
    Keywords: Chemistry ; Organic Chemistry
    Source: Wiley InterScience Backfile Collection 1832-2000
    Topics: Chemistry and Pharmacology
    Type of Medium: Electronic Resource
    URL: http://dx.doi.org/10.1002/hlca.19180010105
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  • 5
    Electronic Resource
    Electronic Resource
    Notiz über ein einfaches Verfahren zur Darstellung von 3,4-Bismethylencyclobuten (1973)
    Weinheim : Wiley-Blackwell
    Berichte der deutschen chemischen Gesellschaft 106 (1973), S. 3461-3462 
    Details
    ISSN: 0009-2940
    Keywords: Chemistry ; Inorganic Chemistry
    Source: Wiley InterScience Backfile Collection 1832-2000
    Topics: Chemistry and Pharmacology
    Type of Medium: Electronic Resource
    URL: http://dx.doi.org/10.1002/cber.19731061031
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  • 6
    Electronic Resource
    Electronic Resource
    [2.2]Paracyclophane durch Addition von Acetylenderivaten an 1,2,4,5-Hexatetraen (1974)
    Weinheim : Wiley-Blackwell
    Berichte der deutschen chemischen Gesellschaft 107 (1974), S. 1891-1902 
    Details
    ISSN: 0009-2940
    Keywords: Chemistry ; Inorganic Chemistry
    Source: Wiley InterScience Backfile Collection 1832-2000
    Topics: Chemistry and Pharmacology
    Description / Table of Contents: Preparation of [2.2]Paracyclophanes by Addition of Acetylene Derivatives to 1,2,4,5-HexatetraeneThe tetrasubstituted [2.2]paracyclophanes 4a - e are formed by cycloaddition of the symmetrical acetylene derivatives 2a - e to 1,2,4,5-hexatetraene (1), and their constitution and configuration is established by spectroscopic methods, degradation and pyrolysis experiments. The tetramethyl ester 4a is reduced to the tetraalcohol 4g, and the tetracarboxylic acid 4c is converted to the bisanhydride 4f and [2.2] paracyclophanes (4h), respectively. All possible disubstituted [2.2] paracyclophanes 6 are obtained when methyl propiolate (5a) is added to. 1, whereas further symmetrical and unsymmetrical acetylene derivatives do not react with 1.
    Notes: Die tetrasubstituierten [2.2]Paracyclophane 4a - e werden durch Cycloaddition der symmetrischen Acetylenderivate 2a - e an 1,2,4,5-Hexatetraen (1) dargestellt und ihre Konstitution und Konfiguration durch spektroskopische Methoden. Abbau- und Pyrolyseversuche bewiesen. Der Tetramethylester 4a wird zum Tetraalkohol 4g reduziert und die Tetracarbonsäure 4c in das Bisanhydrid 4f bzw. [2.2] Paracyclophan (4h) übergeführt. Bei der Anlagerung von Propiolsäure-methylester (5a) an 1 werden alle isomeren disubstituierten [2.2]paracyclophanes 6 erhalten. Weitere symmetrische und unsymmetrische Acetylenderivate reagieren nicht mit 1.
    Additional Material: 3 Tab.
    Type of Medium: Electronic Resource
    URL: http://dx.doi.org/10.1002/cber.19741070613
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  • 7
    Electronic Resource
    Electronic Resource
    Kristallisationsvorgänge in ternären Systemen aus Chloriden von einwertigen und zweiwertigen Metallen. I (1917)
    Weinheim : Wiley-Blackwell
    Zeitschrift für anorganische Chemie 99 (1917), S. 50-66 
    Details
    ISSN: 0863-1786
    Keywords: Chemistry ; Inorganic Chemistry
    Source: Wiley InterScience Backfile Collection 1832-2000
    Topics: Chemistry and Pharmacology
    Additional Material: 11 Ill.
    Type of Medium: Electronic Resource
    URL: http://dx.doi.org/10.1002/zaac.19170990107
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  • 8
    Electronic Resource
    Electronic Resource
    Recherches dans la série des cyclitols XXXIX RMN. de protons d'hydroxyles de cyclopentane- et de cyclopentène-polyols (1970)
    New York, NY : Wiley-Blackwell
    Helvetica Chimica Acta 53 (1970), S. 1511-1525 
    Details
    ISSN: 0018-019X
    Keywords: Chemistry ; Organic Chemistry
    Source: Wiley InterScience Backfile Collection 1832-2000
    Topics: Chemistry and Pharmacology
    Notes: Several mono-, di-, and tri-hydroxy derivatives of cyclopentane and cyclopentene have been studied by NMR. spectroscopy. The chemical shifts and the coupling constants of the OH groups have been correlated with their position, with their configuration and, in some cases, with their conformation.
    Additional Material: 3 Ill.
    Type of Medium: Electronic Resource
    URL: http://dx.doi.org/10.1002/hlca.19700530637
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  • 9
    Electronic Resource
    Electronic Resource
    Die Komplexbildung der neutralen Amidgruppe mit Cu2+ in wässeriger Lösung (1971)
    New York, NY : Wiley-Blackwell
    Helvetica Chimica Acta 54 (1971), S. 1361-1369 
    Details
    ISSN: 0018-019X
    Keywords: Chemistry ; Organic Chemistry
    Source: Wiley InterScience Backfile Collection 1832-2000
    Topics: Chemistry and Pharmacology
    Notes: The interaction between Cu2+ and the terdentate ligands N-picolinoyl-ethylenediamine, glycine-2-pyridylmethylamide, Nα-(2-pyridylmethyl)-glycinamide and Nα-(2-pyridylmethyl)-glycine-ethylamide, respectively, has been studied by spectrophotometry and potentiometry. At high pH values the ionised amide group undergoes complex formation and the resulting chelates have similar structures and stabilities. In slightly acidic solution however, each ligand gives rise to a different species. These facts are explained by assuming that the neutral amide group coordinates through its carbonyl oxygen atom. The stability constant and the absorption spectrum of each complex have been calculated by computer programmes.
    Additional Material: 4 Ill.
    Type of Medium: Electronic Resource
    URL: http://dx.doi.org/10.1002/hlca.19710540516
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  • 10
    Electronic Resource
    Electronic Resource
    Komplexe mit makrocyclischen Liganden, II1. Mitteilung: s. [1].. Zweischrittmechanismus bei der Komplexbildung von Cu2+ mit meso-5,7,7,12,14,14-Hexamethyl-1,4,8,11-tetraazacyclotetradecan (1971)
    New York, NY : Wiley-Blackwell
    Helvetica Chimica Acta 54 (1971), S. 2307-2312 
    Details
    ISSN: 0018-019X
    Keywords: Chemistry ; Organic Chemistry
    Source: Wiley InterScience Backfile Collection 1832-2000
    Topics: Chemistry and Pharmacology
    Notes: The complex formation between CuII and the title compound (tet a) is studied by spectrophotometry and pH-stat techniques. Between pH 4 and 5,5 the reaction proceeds in two steps, the first giving a blue intermediate, Cu(teta)2+ (blue), exhibiting a broad absorption band at 620 nm. Titration with NaOH and the absorption spectrum suggest that, in the intermediate, CuII is coordinated to only two amino groups of the ligand. Both steps are slow compared to other complex formation reactions of CuII. The rate of the first step, in which Cu(tet a)2+ (blue) is formed, is given by v1 = k1 · [Cu2+] [(tet a) H2+2]/[H+] with k1 = 2,7 · 10-6 s-1 at 40° and I = 0,1. In the second step the last two nitrogens of the quadridentate ligand are bound to CuII, giving the mauve end product. The rate of this step is given by v2 = k2 · [Cu(tet a)OH+ (blue)] [OH-] with k2 = 1,2 · 103 M-1 s-1 at 50° and I = 0,5.
    Additional Material: 3 Ill.
    Type of Medium: Electronic Resource
    URL: http://dx.doi.org/10.1002/hlca.19710540770
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