939 results on '"Engels, Bernd"'
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52. Unexpected formation of a dodecanuclear {CoII6CuII6} nanowheel under ambient conditions: magneto-structural correlations
53. One- and two-electron reduction of triarylborane-based helical donor–acceptor compounds
54. Tabu search based global optimization algorithms for problems in computational chemistry
55. Rational design of substituted N-Alkoxypyridine-2(1H)thiones with increased stability against daylight
56. Femtosecond dynamics of the tert-butyl radical, t-[C.sub.4][H.sub.9]
57. Naphthoquinones as covalent reversible inhibitors of cysteine proteases-studies on inhibition mechanism and kinetics
58. Unsubstituted bicyclo[1.1.0]but-2-yicarbinyl cations
59. On the homolytic cleavage of the N,O bond in N-(methoxy)pyridine-2(1H)-thione and N-(methoxy)thiazole-2(3H)-thione in thermally and photochemically induced reactions: A theoretical study
60. Isolation and Reactivity of an Antiaromatic s‐Block Metal Compound
61. Isolierung und Reaktivität eines s‐Block‐Metall‐Antiaromaten
62. Reduction and Rearrangement of a Boron(I) Carbonyl Complex
63. Reduktion und Umlagerung eines Bor(I)‐Carbonylkomplexes
64. Spatial Anisotropy of Charge Transfer at Perfluoropentacene–Pentacene (001) Single-Crystal Interfaces and its Relevance for Thin Film Devices
65. Highly Conjugated π‐Systems Arising from Cannibalistic Hexadehydro‐Diels–Alder Couplings: Cleavage of C−C Single and Triple Bonds
66. Functionalization of N 2 via Formal 1,3‐Haloboration of a Tungsten(0) σ‐Dinitrogen Complex
67. A combined computational and experimental study of the hydrogen-bonded dimers of xanthine and hypoxanthine
68. QM/MM Investigations Of Organic Chemistry Oriented Questions
69. Conformation and hydrogen bonding properties of an Aziridinyl peptide: X-ray structure analysis, Raman spectroscopy and theoretical investigations
70. Challenging Problems in Charge Density Determination: Polar Bonds and Influence of the Environment
71. Di(2-pyridyl)-Amides and -Phosphides: Syntheses, Reactivity, Structures, Raman-Experiments and Calculations
72. On the regioselectivity of the cyclization of enyne-ketenes: a computational investigation and comparison with the Myers-Saito and Schmittel reaction
73. Computational assessment of the electronic structures of cyclohexa-1,2,4-triene, 1-oxacyclohexa-2,3,5-triene (3delta(super 2)-pyran), their benzo derivatives, and cyclohexa-1,2-diene. An experimental approach to 3delta(super 2)-pyran
74. An experimental and computational study on the reactivity and regioselectivity for the nitrosoarene ene reaction: Comparison with triazolinedione and singlet oxygen
75. The importance of the ene reaction for the C2-C6 cyclization of enyne-allenes
76. cAAC‐Stabilized 9,10‐diboraanthracenes—Acenes with Open‐Shell Singlet Biradical Ground States
77. cAAC‐stabilisierte 9,10‐Diboraanthracene – offenschalige Singulettbiradikale
78. Role of Intermolecular Interactions in the Excited-State Photophysics of Tetracene and 2,2′-Ditetracene
79. Oxidation, Coordination, and Nickel‐Mediated Deconstruction of a Highly Electron‐Rich Diboron Analogue of 1,3,5‐Hexatriene
80. Boranediyl‐ and Diborane(4)‐1,2‐diyl‐Bridged Platinum A‐Frame Complexes
81. Diborane(4) Azides: Surprisingly Stable Sources of Transient Iminoboranes
82. Diboran(4)azide als stabile Quelle für kurzlebige Iminoborane
83. Predicting 19 F NMR Chemical Shifts: A Combined Computational and Experimental Study of a Trypanosomal Oxidoreductase–Inhibitor Complex
84. Naphthoquinones as Covalent Reversible Inhibitors of Cysteine Proteases—Studies on Inhibition Mechanism and Kinetics
85. New Cysteine Protease Inhibitors: Electrophilic (Het)arenes and Unexpected Prodrug Identification for the Trypanosoma Protease Rhodesain
86. Tuneable reduction of cymantrenylboranes to diborenes or borylene-derived boratafulvenes
87. Lewis-Base Stabilization of the Parent Al(I) Hydride under Ambient Conditions
88. Studies on the stereochemistry of 1,2,6-trimethyl-4-piperidone
89. Ab Initio Post-Hartree-Fock Calculations of Hyperfine Coupling Tensors and Their Comparison with DFT Approaches
90. Ab initio investigation of the stability of Si3C3 clusters and their structural and bonding features
91. Flowsheeting-based simulation of recycling concepts in the metal industry
92. Unexpected formation of a dodecanuclear {CoII6CuII6} nanowheel under ambient conditions: magneto-structural correlations.
93. A general ansatz for constructing quasi-diabatic states in electronically excited aggregated systems.
94. Recent Developments in Configuration Interaction and Density Functional Theory Calculations of Radical Hyperfine Structure.
95. Isolation of Neutral, Mono‐, and Dicationic B2P2 Rings by Diphosphorus Addition to a Boron−Boron Triple Bond.
96. Isolierung neutraler, mono‐ und dikationischer B2P2‐Ringe durch Addition eines Diphosphans an eine Bor‐Bor‐Dreifachbindung.
97. Isolation of diradical products of twisted double bonds
98. Bindungsstärkende Rückbindung in Aminoborylen‐stabilisierten Aminoborylenen: an der Grenze zwischen Borylenen und Diborenen
99. Bond‐Strengthening Backdonation in Aminoborylene‐Stabilized Aminoborylenes: At the Intersection of Borylenes and Diborenes
100. Tuning the Product Spectrum of a Glycoside Hydrolase Enzyme by a Combination of Site‐Directed Mutagenesis and Tyrosine‐Specific Chemical Modification
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