@article{ChristlReichRoberts1971, author = {Christl, Manfred and Reich, H. J. and Roberts, J. D.}, title = {Nuclear Magnetic Resonance Spectroscopy. Carbon-13 Chemical Shifts of Methylcyclopentanes, Cyclopentanols, and Cyclopentyl Acetates}, url = {http://nbn-resolving.de/urn:nbn:de:bvb:20-opus-57862}, year = {1971}, abstract = {No abstract available}, subject = {Organische Chemie}, language = {en} } @article{ChristlRoberts1972, author = {Christl, Manfred and Roberts, J. D.}, title = {Nuclear Magnetic Resonance Spectroscopy : Carbon-13 Chemical Shifts of Small Peptides as a Function of pH}, url = {http://nbn-resolving.de/urn:nbn:de:bvb:20-opus-57885}, year = {1972}, abstract = {No abstract available}, subject = {Organische Chemie}, language = {en} } @article{ChristlRoberts1972, author = {Christl, Manfred and Roberts, John D.}, title = {Carbon-13 Nuclear Magnetic Resonance Spectroscopy : Conformational Analysis of Methyl-Substituted Cycloheptanes, Cycloheptanols, and Cycloheptanones}, url = {http://nbn-resolving.de/urn:nbn:de:bvb:20-opus-41663}, year = {1972}, abstract = {The 130 chemical shifts were determined of the carbons in 12 cycloheptanes, 21 cycloheptanols, and 8 cycloheptanones. In some cyc1oheptanols and cyc1oheptanones, the assignments have been obtained unambiguously by the synthesis of deuterated derivatives and the use of paramagnetic-shift reagents. Substituent effects for the different types of groups have been calculated. The most informative data about the cyc10heptane conformations were provided by the relatively well understood I' effects. The results are generally in,good agreement with predictions based on the twist-chair form, which has been predicted by Hendrickson to be the most stable conformation. Pairs of cis-trans isomers are found to have rather characteristic differences in their 130 spectra. This fact was used to assign the resonances found for cis-trans mixtures of methyl-substituted cyc1oheptanols to specific isomers.}, language = {en} } @article{ChristlWarrenHawkinsetal.1973, author = {Christl, Manfred and Warren, J. D. and Hawkins, B. L. and Roberts, J. D.}, title = {\(^{13}\)C and \(^{15}\)N Nuclear Magnetic Resonance Spectroscopy of Nitrile Oxides and Related Reaction Products : Unexpected \(^{13}\)C and \(^{15}\)N Nuclear Magnetic Resonance Parameters of 2,4,6-Trimethylbenzonitrile Oxide}, url = {http://nbn-resolving.de/urn:nbn:de:bvb:20-opus-57894}, year = {1973}, abstract = {No abstract available}, subject = {Organische Chemie}, language = {en} } @article{BruentrupChristl1973, author = {Br{\"u}ntrup, Gisela and Christl, Manfred}, title = {Darstellung und Thermolyse der Hexamethyldewarbenzol-Cycloaddukte aromatischer Nitriloxide und des Diphenylnitrilimins}, url = {http://nbn-resolving.de/urn:nbn:de:bvb:20-opus-30257}, year = {1973}, abstract = {No abstract available}, language = {en} } @article{ChristlBruentrup1974, author = {Christl, Manfred and Br{\"u}ntrup, Gisela}, title = {Diimine Reduction and Ozonolysis of Benzvalene}, url = {http://nbn-resolving.de/urn:nbn:de:bvb:20-opus-57953}, year = {1974}, abstract = {Via reduction of benzvalene (1) with diirnine tricyclo[3.1.0.02•6]hexane is obtained in good yield. The procedure renders 3, which has already been synthesized by Lemal and Shim, accessible much easier and in larger quantities. IH and 13C n.m.r. spectroscopic data are discussed. Both the thermal and the AgBF4-catalyzed rearrangernent of 3 yield 1,3-cyclohexadiene (8). - The ozonolysis of 1 with subsequent LiAIH4-reduction results in cis-I,3- bis(hydroxyrnethyl)cyclobutane (13a).}, subject = {Organische Chemie}, language = {en} } @article{ChristlHeinemannKristof1975, author = {Christl, Manfred and Heinemann, U. and Kristof, W.}, title = {Thermal Rearrangement of Some Endo-Endo'-Bridged Bicyclo[1.1.0]butanes}, url = {http://nbn-resolving.de/urn:nbn:de:bvb:20-opus-57967}, year = {1975}, abstract = {No abstract available}, subject = {Organische Chemie}, language = {en} } @article{Christl1975, author = {Christl, Manfred}, title = {Carbon-13 Chemical Shifts and 13C-15N Coupling Constants of 3,4-Dihydroisoquinoline-15N, its 15N-Oxide and their Conjugate Acids}, url = {http://nbn-resolving.de/urn:nbn:de:bvb:20-opus-30071}, year = {1975}, abstract = {No abstract available}, language = {en} } @article{VolzShinPrinzbachetal.1978, author = {Volz, H. and Shin, J.-H. and Prinzbach, H. and Babsch, H. and Christl, Manfred}, title = {Stability of Tricyclo[4.1.0.0\(^{2,7}\)]heptenyl-Cations}, url = {http://nbn-resolving.de/urn:nbn:de:bvb:20-opus-58001}, year = {1978}, abstract = {No abstract available}, subject = {Organische Chemie}, language = {en} } @article{ChristlHerbert1979, author = {Christl, Manfred and Herbert, R.}, title = {Unusual Carbon Shielding Effects of Cyclopropanes and Double Bonds in Strained Bicyclo[3.1.0]hexanes and Cyclopentenes}, url = {http://nbn-resolving.de/urn:nbn:de:bvb:20-opus-58038}, year = {1979}, abstract = {Carbon-13 shieldings and one-bond \(^{13}\)C-H coupling constants of bicydo[2.1.1]hexane, bicydo[2.l.l]hex- 2-ene, tricydo[3.1.1.0\(^{2.4}\)]heptane and benzvalene are presented and compared. to the data of related. compounds. H a bicydo[3.1.0]hexane system is part of a rigid skeleton, the cydopropane ring exerts spedfk: 'Y substituent eflects of two ldnds. In the case of the bicyclobexane boat form an upfield shift of the C-3 signal is observed and in tbe esse of the chair form a downfield shift of 15-20 ppm. Compared to the corresponding cydopentanes the double bond in strained cydopentenes causes downfield shifts of the C-4 absorption. 1bis eftect increases witb increasing strain, reaching 8 45.9 ppm maximum in benzvalene. Hence it is tbe only known bicydo[l.l.O]butane baving 8 reversed order of carbon shieldings. The downfield shifts are e:xplained by means of simple orbital interaction schemes.}, subject = {Organische Chemie}, language = {en} } @article{ChristlLang1982, author = {Christl, Manfred and Lang, R.}, title = {Tricyclo[5.1.0.0\(^{2,8}\)]octa-3,5-diene (Octavalene)}, url = {http://nbn-resolving.de/urn:nbn:de:bvb:20-opus-58124}, year = {1982}, abstract = {No abstract available}, subject = {Organische Chemie}, language = {en} } @article{LeiningerLanzendoerferChristl1983, author = {Leininger, H. and Lanzend{\"o}rfer, F. and Christl, Manfred}, title = {{\"U}ber die Reduktion des Benzvalenozonids zum cis-1,3-Cyclobutandimethanol mit LiAlH\(_4\)}, url = {http://nbn-resolving.de/urn:nbn:de:bvb:20-opus-58130}, year = {1983}, abstract = {No abstract available}, subject = {Organische Chemie}, language = {en} } @article{ChristlLeiningerMattauch1983, author = {Christl, Manfred and Leininger, Hartmut and Mattauch, Brigitte}, title = {The 13C NMR Spectra of Some Tricyclo[2.2.0.02,6]hexane Derivatives : Unexpected High Field Absorptions Due to Additive gamma-anti Subsituent Effects}, isbn = {x}, url = {http://nbn-resolving.de/urn:nbn:de:bvb:20-opus-41620}, year = {1983}, abstract = {By means of the BC NMR spectra of tricyclo{2.2.0~rfJ6Jhexane and thirteen of its derivatives the effects of substituents in endo-3- and endo-5-positions on the HC chemical shifts have been determined. The y-anti effects are at least as Jarge as in monosubstituted cyc1obutanes, where the shielding values of second-row hetero substituents exceed those in unstrained systems by far, and higher-row and carbon substituents still cause substantial upfield shifts. In the title system the y-anti effect of a substituent in the endo-3- and endo-5-position are operative additively, and thus shift the absorption of C-J upfieJd by a maximum of 27 ppm with respect to the unsubstituted hydrocarbon.}, language = {en} } @article{LanzendoerferChristl1983, author = {Lanzend{\"o}rfer, Franz and Christl, Manfred}, title = {3,4-Bismethylentricyclo[3.1.0.02,6]hexan - Synthese und Diels-Alder-Addition an Tetracyanethylen}, url = {http://nbn-resolving.de/urn:nbn:de:bvb:20-opus-30263}, year = {1983}, abstract = {No abstract available}, language = {en} } @article{ChristlLeiningerBrueckner1983, author = {Christl, Manfred and Leininger, Hartmut and Br{\"u}ckner, Dieter}, title = {On the Nature of the Bicyclo [3.2.1]octa-3,6-dien-2-yl Anion: A 13C NMR spectroscopic study}, url = {http://nbn-resolving.de/urn:nbn:de:bvb:20-opus-30060}, year = {1983}, abstract = {No abstract available}, language = {en} } @article{ChristlBrunnLanzendorfer1984, author = {Christl, Manfred and Brunn, Erich and Lanzendorfer, Franz}, title = {Reactions of Benzvalene with Tetracyanoethylene, 2,3-Dichloro-5,6-dicyano-rho-benzoquinone, Chlorosulfonyl Isocyanate, and Sulfur Dioxide. Evidence for Concerted 1,4-Cycloadditions to a Vinylcyclopropane System}, url = {http://nbn-resolving.de/urn:nbn:de:bvb:20-opus-30052}, year = {1984}, abstract = {No abstract available}, language = {en} } @article{GleiterBischofGubernatoretal.1985, author = {Gleiter, Rolf and Bischof, Peter and Gubernator, Klaus and Christl, Manfred and Schwager, Luis and Vogel, Pierre}, title = {2,3-Bis(methylene)bicyclo[2.1.1]hexane and 3,4-Bis(methylene)tricyclo[3.1.0.0\(^{2,6}\)]hexane : Interaction between a π System and a Cyclobutane or Bicyclobutane Moiety}, url = {http://nbn-resolving.de/urn:nbn:de:bvb:20-opus-31845}, year = {1985}, abstract = {The He (I) photoelectron spectra of 2-bicyclo[2.1.l]hexene (1), 2,3-bis(methylene)bicyclo[2.1.l]hexane (3), and 3,4-bis(methylene)tricyclo[3.l.O.0\(^{2.6}\)]hexane (4) have been investigated. The assignment given is based on a ZDO model and semiempirical calculations. Tagether with the PE data of benzvalene (2), the reported data allow a comparison between 1-2 and 3-4. This yields a measure of the interactions between 8 cyclobutane or 8 bicyclobutane moiety and a double bond system within a ZDO model. The resonance integral found in the case of 1 and 3 amounts to -1.9 eV, that for 2 and 4, to -2.3 eV. The investigations furthermore reveal that the electronic factors which contribute to the higher reactivity of the bicyclobutane compounds amount to 5 kcal/mol.}, subject = {Chemie}, language = {en} } @article{ChristlLangHerzog1986, author = {Christl, Manfred and Lang, R. and Herzog, C.}, title = {The Synthesis of Octavalene (Tricyclo[5.1.0.0\(^{2,8}\)]octa-3,5-diene) and Several Substituted Octavalenes}, url = {http://nbn-resolving.de/urn:nbn:de:bvb:20-opus-58254}, year = {1986}, abstract = {No abstract available}, subject = {Organische Chemie}, language = {en} } @article{EngelsPeyerimhoff1986, author = {Engels, Bernd and Peyerimhoff, S. D.}, title = {Theoretical study of the bridging in β-Halo Ethyl}, url = {http://nbn-resolving.de/urn:nbn:de:bvb:20-opus-58779}, year = {1986}, abstract = {Large-acale multi-reference configuration interaction (MRD-CI) calculations in a quite flexible AO basis are employed to study the energy hypersurface for the reaction intermediates XC\(_3\)H\(_4\) with X = Cl, Br and F. Particular emphasis is therby placed on determining the equilibrium conformations, the CH\(_2\) rotation barrier and the energy surface for a possible bridging (shuttling motion (1a] of X between the two carbon centers). The absolute minimum in the potential energy surface is found in all three cases for the asymmetric ß-halo radical in general agreement with ESR data at an XCC angle of ca. 110°, a c-c separation somewhat shorter than a single bond and an approximate sp3 type hybridization (\(\alpha _2 \approx \) 135-140°). In FC\(_2\)H\(_4\) the energy difference between the minimum in the symmetric conformation and the absolute minimum is found to be more than 30 kcal so that shuttling seems impossible in agreement with experimental findings. In BrC\(_2\)H\(_4\) the difference between these two potential minima is only between 1-2 kcal, i.e., smaller than the barrier to CH\(_2\), rotation, so that· shuttling is favored, while ClC\(_2\)H\(_4\) takes an intermediate position between these extremes. The use of correlated wavefunctions is found to be quite important for such a study; the results are related to various kinetic studies of these radicals.}, subject = {Organische Chemie}, language = {en} } @article{GleiterBischofChristl1986, author = {Gleiter, Rolf and Bischof, Peter and Christl, Manfred}, title = {Electronic Structure of Octavalene : Photoelectron Spectroscopic Investigations}, url = {http://nbn-resolving.de/urn:nbn:de:bvb:20-opus-31588}, year = {1986}, abstract = {The He I photoelectron (PE) spectra of octavalene (5) as weil as its hydrogenated products 6-8 have been investigated. The assignment given is based on an empirical comparison of 5-8 with related compounds, a ZDO model, and semiempirical and ab initio calculations. Within the ZDO model the interaction between the buta.diene moiety and the bicyclobutane fragment of 5 is described by a resonance integral of -2.3 eV. The orbitalsequence of 5 is found tobe 2a\(_2\) (\(\pi\)-\(\sigma\)), 9a\(_1\) (\(\sigma\)), 3b1 (\(\pi\) - \(\sigma\)), 1a\(_2\) (\(\sigma\) + \(\pi\)), 2b\(_1\) (\(\sigma\) + \(\pi\)).}, subject = {Chemie}, language = {en} }