All Stories

  1. Reduction of organic azides by indyl-anions. Isolation and reactivity studies of indium–nitrogen multiple bonds
  2. Reactions of In–Zn bonds with organic azides: products that result from hetero- and homo-bimetallic behaviour
  3. Reduction vs. Addition: The Reaction of an Aluminyl Anion with 1,3,5,7-Cyclooctatetraene
  4. Halogenated Meroditerpenoids from a South Pacific Collection of the Red Alga Callophycus serratus
  5. Indyllithium and the Indyl Anion [InL]− : Heavy Analogues of N-Heterocyclic Carbenes
  6. Indyllithium and the Indyl Anion [InL]− : Heavy Analogues of N-Heterocyclic Carbenes
  7. Carbon Nano-onions as Photosensitizers: Stacking-Induced Red-Shift
  8. Carbodiimides as catalysts for the reduction of a cadmium hydride complex
  9. Catalytic oxidative coupling promoted by bismuth TEMPOxide complexes
  10. Unraveling aminophosphine redox mechanisms for glovebox-free InP quantum dot syntheses
  11. Buckminster fullerene adhesion on graphene flakes: Numerical accuracy of dispersion corrected DFT
  12. Guest–Host Interaction of Coinage Metals in π-Rich Cavities
  13. Accurate prediction of the optical rotation and NMR properties for highly flexible chiral natural products
  14. Choosing the right precursor for thermal decomposition solution-phase synthesis of iron nanoparticles: tunable dissociation energies of ferrocene derivatives
  15. Structure of Echivulgarine, a Pyrrolizidine Alkaloid Isolated from the Pollen of Echium vulgare
  16. Isolation and Characterization of a Bismuth(II) Radical
  17. Homogeneous Catalysis with AuIII: Insights into the Mechanism of the Alkoxylation of Alkynes
  18. How to choose a precursor for decomposition solution-phase synthesis: the case of iron nanoparticles
  19. 13 C NMR Analysis of 3,6-Dihydro-2 H -pyrans: Assignment of Remote Stereochemistry Using Axial Shielding Effects
  20. Molecular excitons in a copper azadipyrrin complex
  21. Accurate density functional theory description of binding constants and NMR chemical shifts of weakly interacting complexes of C60 with corannulene-based molecular bowls
  22. Mechanism of Copper(I)-Catalyzed Allylic Alkylation of Phosphorothioate Esters: Influence of the Leaving Group on α Regioselectivity
  23. Identification of non-classical C–H⋯M interactions in early and late transition metal complexes containing the CH(ArO)3 ligand
  24. Why compete when you can share? Competitive reactivity of germanium and phosphorus with selenium
  25. Correction to Homogeneous Gold Catalysis: Mechanism and Relativistic Effects of the Addition of Water to Propyne
  26. Studies of the H–D exchange mechanism of malonganenone B
  27. Electronic Structure of Main-Group CompoundsBased in part on the article Electronic Structure of Main Group Compounds by Jeremy K. Burdett which appeared in theEncyclopedia of Inorganic Chemistry, First Edition.
  28. Packed to the Rafters: Filling up C60 with Rare Gas Atoms
  29. Highly Fluxional [Y(C(SiH(CH 3 ) 2 ) 3 ) 3 ]: A DFT Characterization of Structure and NMR Spectra
  30. Analysis of M⋯H–Si interactions in [{M(CpSiMe2H)Cl3}2], (M = Zr, Hf, Ti and Mo) complexes
  31. Homogeneous Gold Catalysis: Mechanism and Relativistic Effects of the Addition of Water to Propyne
  32. ChemInform Abstract: Theoretical Chemistry of Gold - From Atoms to Molecules, Clusters, Surfaces and the Solid State
  33. Kinetic and Thermodynamic Stability of the Group 13 Trihydrides
  34. A systematic density functional and wavefunction-based study on dicarboxyl dianions −O2C–R–CO2 − with R = C2, C2X2, C2X4, and C6X4 (X = H, F)
  35. Characterization of agostic interactions in theory and computation
  36. The adsorption of CO on charged and neutral Au and Au2: A comparison between wave-function based and density functional theory
  37. Convergence of the many-body expansion of interaction potentials: From van der Waals to covalent and metallic systems
  38. The strength of the σ-, π- and δ-bonds in Re2Cl 8 2−
  39. The Search for the Species with the Highest Coordination Number
  40. The Search for the Species with the Highest Coordination Number
  41. Theoretical investigations into trioxo group 7 compounds LRO3 with perfluorated ligands
  42. Electronic Structure of Main-Group CompoundsBased in part on the article Electronic Structure of Main Group Compounds by Jeremy K. Burdett which appeared in theEncyclopedia of Inorganic Chemistry, First Edition.
  43. Why Do the Heavy-Atom Analogues of Acetylene E2H2 (E: Si—Pb) Exhibit Unusual Structures?
  44. Why Do the Heavy-Atom Analogues of Acetylene E 2 H 2 (E = Si−Pb) Exhibit Unusual Structures?
  45. C5H4?BR2 Bending in Ferrocenylboranes: A Delocalized Through-Space Interaction Between Iron and Boron
  46. The nature of the chemical bond in the light of an energy decomposition analysis
  47. Where Are the Hydrogen Atoms in [(η 5 -C 5 H 5 )(PH 3 ) 2 W(H 2 SiMe 2 )] + ? A Theoretical Study
  48. Chemical Bonding in Octahedral XeF 6 and SF 6
  49. Christian Klixbull Jørgensen and the Nature of the Chemical Bond in HArF
  50. A Novel Class of Aromatic Compounds: Metal-Centered Planar Cations [Fe(Sb5)]+ and [Fe(Bi5)]+.
  51. Structures and Bonding of the Sandwich Complexes [Ti(η 5 -E 5 ) 2 ] 2- (E = CH, N, P, As, Sb):  A Theoretical Study †
  52. A Novel Class of Aromatic Compounds: Metal-Centered Planar Cations [Fe(Sb5)] and [Fe(Bi5)]
  53. Metal Germylyne Complexes [M⋮Ge−R] and Metallogermylenes [M−Ge−R]:  DFT Analysis of the Systems [(Cp)(CO) n M⋮GeMe] (M = Cr, Mo, W, Fe 2+ , n = 2; M = Fe, n = 1) and [(Cp)(CO) n M−GeMe] (M = Cr, Mo, W, n = 3; M = Fe, n = 2)
  54. Energy decomposition analysis of the chemical bond in main group and transition metal compounds
  55. Structures, Metal−Ligand Bond Strength, and Bonding Analysis of Ferrocene Derivatives with Group-15 Heteroligands Fe(η5-E5)2and FeCp(η5-E5) (E = N, P, As, Sb). A Theoretical Study†
  56. Die Gretchenfrage: gebunden oder ungebunden?
  57. Iron Bispentazole Fe(η5-N5)2, a Theoretically Predicted High-Energy Compound: Structure, Bonding Analysis, Metal-Ligand Bond Strength and a Comparison with the Isoelectronic Ferrocene
  58. Search for a Parity-Violating Energy Difference between Enantiomers of a Chiral Iron Complex
  59. Theoretical Chemistry of Gold– From Atoms to Molecules, Clusters, Surfaces and the Solid State