M. Hofmann

发表

Methylzinc tetrahydroborate: investigation of the vapour phase by spectroscopic and quantum chemical techniques

S. Aldridge, A. J. Downs, M. Hofmann, 1998 .

Methylsilylhydroxylamines: preparative, spectroscopic and ab initio studies

P. Schleyer, M. Hofmann, H. Schmidbaur, 1994 .

Structural paradigms in macropolyhedral boranes.

M. Hofmann, Farooq A Kiani, 2008, Chemistry.

Density functional theory studies of model complexes for molybdenum-dependent nitrate reductase active sites

M. Hofmann, 2007, JBIC Journal of Biological Inorganic Chemistry.

The mechanism of Mo-/Cu-dependent CO dehydrogenase

M. Hofmann, T. Graf, J. K. Kassube, 2005, JBIC Journal of Biological Inorganic Chemistry.

2,3,4-Tricarba-nido-hexaboranes(7) with a Bridging B-Ethyl-B Moiety

P. Schleyer, M. Hofmann, B. Wrackmeyer, 1998 .

On, off and intermediate coordination of a bridgehead triarylamine donor in tripodal complexes: towards the tuning of coordinative bond distance.

R. Krämer, M. Hofmann, H. Pritzkow, 2004, Dalton transactions.

Electronic state of the dimethyl sulfoxide reductase active site.

M. Hofmann, 2008, Inorganic chemistry.

Acid Rain: Ab Initio Investigation of the H2O SO3 Complex and Its Conversion into H2SO4.

P. Schleyer, M. Hofmann, 1994 .

Why do two π-electron four-membered Hückel rings pucker?

P. Schleyer, M. Hofmann, A. Berndt, 2012, Organic letters.

Syntheses and DFT/GIAO/NMR Study of Polyhedral Selenaboranes: The First Selenahexaborane(5) closo‐1‐SeB5Cl5

M. Hofmann, W. Keller, 2017 .

Macropolyhedral thiaboranes with unusual arachno subclusters: a computational investigation

Sascha K. Goll, M. Hofmann, 2002 .

Methylsilylhydroxylamines: preparative, spectroscopic and ab initio studies

P. Schleyer, M. Hofmann, H. Schmidbaur, 1995 .

Decisive electron correlation effects on computed boron-11 and carbon-13 NMR chemical shifts. Application of the GIAO-MP2 method to boranes and carbaboranes

P. Schleyer, M. Bühl, M. Hofmann, 1993 .

Six-vertex nido-carborane structures with unusual CHB bridges or endo-CH hydrogens

P. Schleyer, M. Hofmann, M. A. Fox, 1998 .

(π+σ)‐double aromatic and π,σ‐mixed aromatic boron compounds with two electrons delocalized over three centers

M. Hofmann, A. Berndt, 2006 .

Very strong anionic homoaromaticity in (deloc-1,3,4)-1-sila-3,4-diboracyclopentane-1-ides, the importance of the energy of the reference system for homoaromatic stabilization energies

W. Massa, M. Hofmann, A. Berndt, 2002 .

The molecular structure of chloromethylphosphine, CClH2PH2, as determined by gas-phase electron diffraction and ab initio computations

H. Robertson, A. J. Downs, M. Hofmann, 1995 .

The Structures and Energies of Phosphaalkyne Trimers, (HCP)3

P. Schleyer, M. Hofmann, M. Regitz, 1999 .

Triboracyclobutanides: four-membered two-electron aromatic compounds with fluctuating skeletal bonds.

W. Massa, M. Hofmann, A. Berndt, 2003, Angewandte Chemie.

A diboracyclopropane with a planar-tetracoordinate carbon atom and a triborabicyclobutane.

G. Subramanian, W. Massa, M. Hofmann, 2003, Angewandte Chemie.

Heteroatom‐Substituted Bicyclo[1.1.1]pentanes with Two Boron Atoms as Electron‐Deficient Centers

M. Unverzagt, P. Schleyer, S. Berger, 1995 .

Electrophilic alkylations in neutral aqueous or alcoholic solutions.

H. Mayr, M. Hofmann, N. Hampel, 2004, Angewandte Chemie.

The relative stabilities of 11-vertex nido- and 12-vertex closo-heteroboranes and -borates: facile estimation by structural or connection increments.

M. Hofmann, Farooq A Kiani, 2006, Dalton transactions.

1-Phenyl-1,2-dicarba-closo-dodecaborane, 1-Ph-1,2-closo-C(2)B(10)H(11). Synthesis, Characterization, and Structure As Determined in the Gas Phase by Electron Diffraction, in the Crystalline Phase at 199 K by X-ray Diffraction, and by ab Initio Computations.

H. Robertson, P. Schleyer, M. Hofmann, 1996, Inorganic chemistry.

Structure and reactivity of the vinylcyclopropane radical cation

H. Schaefer, M. Hofmann, 2001 .

Four-membered Rings with Two Heteroatoms including Phosphorus to Bismuth

M. Hofmann, U. Zenneck, 1996 .

A Novel Hexamer of ButC P: Synthesis, Structure, and Theoretical Studies

J. F. Nixon, P. Schleyer, P. Hitchcock, 1994 .

Two-electron homoaromatics with heteroatom bridges

M. J. Bayer, P. Schleyer, W. Massa, 2003 .

Dianions of tetraboranes(4): puckered aromatic four-membered rings and their reactions with conservation of aromaticity.

W. Massa, M. Hofmann, A. Berndt, 2003, Angewandte Chemie.

Triboracyclopropanates: two-electron double aromatic compounds with very short B-B distances.

W. Massa, M. Hofmann, A. Berndt, 2002, Angewandte Chemie.

Two-electron aromatics containing three and four adjacent boron atoms

W. Massa, M. Hofmann, A. Berndt, 2003 .

Ortho-, Meta-, and Para-Directing Influence of Transition-Metal Fragments in 12-Vertex closo-Cyclopentadienylmetallaheteroboranes: Additive Nature of Structural Increments

M. Hofmann, Farooq A Kiani, 2006 .

Syntheses and Reactions of a Stable 1,2‐Dichloro‐1,2‐diborolane and Aromatic Tetraboranes

W. Massa, M. Hofmann, A. Berndt, 2004 .

A New Carborane Cage: Hexacarba-arachno-dodecaborane(12).

P. Schleyer, M. Hofmann, B. Wrackmeyer, 1998, Angewandte Chemie.

A planar, aromatic bicyclo-tetraborane(4).

M. Hofmann, H. Pritzkow, W. Siebert, 2002, Angewandte Chemie.

The structures of a tetracarba-nido-octaborane(8) and a novel spiro derivative of a 2,3,5-tricarba-nido-hexaborane(7).

P. Schleyer, M. Hofmann, B. Wrackmeyer, 1999 .

Derivatives of the simplest polyhedral carborane anion: structures at the borderline between two- and three-dimensional aromatic compounds.

W. Massa, M. Hofmann, A. Berndt, 2005, Angewandte Chemie.

Hydridogallium Bis(tetrahydroborate) in the Gas Phase: Vibrational Properties and Structure Determined by Electron Diffraction and ab Initio and Density Functional Theory Computations

H. Robertson, P. Schleyer, A. J. Downs, 1995 .

Density functional theory study of model complexes for the revised nitrate reductase active site in Desulfovibrio desulfuricans NapA

M. Hofmann, 2009, JBIC Journal of Biological Inorganic Chemistry.

What is the best theoretical method to study molybdenum dithiolene complexes

M. Hofmann, 2006 .

Tetraphosphatricyclo[4.2.0.02,5]octadienes; New Phosphaalkyne Cyclotetramers Derived from λ3σ2‐Diphosphetes

J. F. Nixon, P. Schleyer, P. Hitchcock, 1995 .

Tetraphosphatricyclo[4.2.0.02, 5]octadiene, neue Phosphaalkin‐Cyclotetramere; intermediäres Auftreten von λ3σ2‐Diphospheten

J. F. Nixon, P. Schleyer, P. Hitchcock, 1995 .

Strong neutral homoaromatics.

W. Massa, M. Hofmann, A. Berndt, 2006, Angewandte Chemie.

Novel tetraalkyltetraboranes of the type B4R4, B4H2R4 and B4H4R4 ☆

P. Schleyer, M. Hofmann, P. Paetzold, 1999 .

Unraveling the Way Acetaldehyde is Formed from Acetylene: A Study Based on DFT

M. Hofmann, U. Habib, Mahum Riaz, 2021, ACS omega.

Reactivity of Perhalogenated Octahedral Phospha- and Arsaboranes toward THF: A Joint Experimental/Computational Study.

M. Hofmann, M. Sárosi, D. Hnyk, 2022, Inorganic chemistry.

Periodic trends and easy estimation of relative stabilities in 11-vertex nido-p-block-heteroboranes and -borates

M. Hofmann, Farooq A Kiani, 2005, Journal of molecular modeling.

Photodissociation dynamics of CO3

M. Hofmann, A. Castleman, D. Hunton, 1985 .

The Additive Nature of Energy Penalties in 10-Vertex nido-(Car)boranes

M. Hofmann, Farooq A Kiani, 2005 .

Azacarbaborane chemistry. Butyl nitrite synthesis of the new eight-, nine- and ten-vertex azacarbaboranes exo- and endo-7-CH3-hypho-7,8-NCB6H11, nido-6,8,9-NC2B7H10, arachno-6,5,9-NC2B7H12 and arachno-6,5,10-C2NB7H12

T. Jelínek, J. Kennedy, M. Bühl, 2003 .

The [C6H10]•+ Hypersurface: the Parent Radical Cation Diels−Alder Reaction

H. Schaefer, M. Hofmann, 1999 .

1,2‐Diboracyclopentanes without Strong Donor Substituents: Synthesis, Reactions, and Computational Analysis

W. Massa, M. Hofmann, A. Berndt, 2008 .

Synthesis and molecular structure of 1,12-dicarba-closo-dodecaborane(12)-1,12-dithiol, 1,12-(SH)2-1,12-C2B10H10, in the gaseous phase, determined by electron diffraction and ab initio calculations; geometrical consequences of three-dimensional aromaticity in carbaboranes 1,12-X2-1,12-C2B10H10

H. Robertson, P. Schleyer, M. Hofmann, 2000 .

Sila-linalool as a pheromone analogue: A study on C/Si bioisosterism

M. Hofmann, W. Francke, R. Tacke, 2003 .

Phosphorus Compounds. Part 91. Tetraphosphatricyclo(4.2.0.02,5) octadienes. New Phosphaalkyne Cyclotetramers Derived from λ3. sigma.2-Diphosphetes.

J. F. Nixon, P. Schleyer, P. Hitchcock, 1995 .

Structural relationships among two vertex sharing macropolyhedral boranes.

M. Hofmann, Farooq A Kiani, 2007, Dalton transactions.

Photodissociation spectroscopy and dynamics of negative ion clusters. II. CO3−⋅(H2O)1,2,3

M. Hofmann, A. Castleman, D. Hunton, 1985 .

Aromatic boranes with planar-tetracoordinate boron atoms and very short B--B distances.

W. Massa, M. Hofmann, A. Berndt, 2002, Angewandte Chemie.

Rules for macropolyhedral boranes

M. Hofmann, Farooq A Kiani, 2009 .

ORGANOPHOSPHORUS COMPOUNDS, 139. - ON THE BEHAVIOR OF 5,8-BIS(TRIMETHYLSILYL)CYCLOOCTA-1,3,6-TRIENE IN CYCLOADDITION REACTIONS AND SUBSEQUENT CHEMISTR Y

M. Hofmann, M. Regitz, U. Bergsträsser, 1999 .

Exotic Structures of Si2B2H4

P. Schleyer, G. Subramanian, A. Korkin, 1997 .

A highly reactive triboracyclobutane and its dianion: Two-electron homoaromatics with nonclassical and classical σ skeletons

W. Massa, M. Hofmann, A. Berndt, 2003 .

Molecular structure of 1-(dichloroboryl)pentaborane(9), in the gas phase as determined by electron diffraction and supported by theoretical calculations

H. Robertson, I. Alberts, P. Schleyer, 1995 .

Reduction of Dicarbapentaboranes(5) to 1,2-Diborata-4-boracyclopentadienes: Antiaromatic Compounds with 4π-Electron Systems†‡

P. Schleyer, W. Massa, M. Hofmann, 1997 .

Carbene Analogues of Boron Stabilized by Neighboring BB Moieties: Doubly Aromatic Bishomotriboriranides†‡

P. Schleyer, G. Subramanian, S. Berger, 1997 .

Transformation of 3,4-Bis(isopropylidene)-2,5-dichloro-1,2,5-thiadiborolane into nido-2,4,5-Thiadicarbahexaborane(5) Derivatives – Formation and Computational Elucidation of a Thiadicarbanonaborane(8) with a ni-9 Configuration

P. Schleyer, M. Hofmann, H. Pritzkow, 1998 .

Molecular structure of gaseous 1,7-dichloro-1,7-dicarba-closo-dodecaborane(12), 1,7-Cl2-1,7-C2B10H10, as studied by electron diffraction and ab lnitio calculations

H. Robertson, P. Schleyer, M. Bühl, 1994 .

Gas-phase reactions of nido-1-methylpentaborane with propyne and 2-pentyne. Formation of B-alkyl nido and closo carbaboranes

P. Schleyer, M. Hofmann, M. A. Fox, 2000 .

THE STRUCTURES OF ALKYL DERIVATIVES OF ARACHNO-1-CB4H10 FROM REACTIONS OF B4H10 WITH ALKYNES

P. Schleyer, M. Hofmann, M. A. Fox, 1994 .

exo‐endo Isomerism of Carboranes: Unusual Geometries of C2B5X7 (X=Cl, Br) and C2B7Cl9 with exo‐Skeletal BCl2 Groups on Carbon Revealed by Joint Spectroscopic/Computational Studies

M. Hofmann, J. Conrad, W. Keller, 2023, ChemistrySelect.

Structures of arachno- and hypho-B(10) Clusters and Stability of Their Possible Lewis Base Adducts ([B(10)H(12)](2-), [B(10)H(12).L](2)(-), [B(10)H(12).2L](2)(-), [B(10)H(13)](-), [B(10)H(13).L](-), [B(10)H(12).2L]). An ab Initio/IGLO/NMR Investigation.

P. Schleyer, M. Hofmann, 1998, Inorganic chemistry.

Existence of C,3-Me2-closo-1,2-C2B3H3 Refuted by the Ab Initio/IGLO, GIAO-MP2/NMR Method. Attempted Repetition of the Synthesis

P. Schleyer, M. Hofmann, M. A. Fox, 1996 .

Carboranes: From Small Organoboranes to Clusters

M. Hofmann, W. Siebert, A. Berndt, 2005 .