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Currently displaying 23921 - 23940 of 30398 publications

Glyoxal studied with 'Multimode', explicit large amplitude motion and anharmonicity

DP Tew, NC Handy, S Carter

Physical Chemistry Chemical Physics

(2001)

1958

(doi: 10.1039/b101631h)

Adsorption behaviour of the binary mixtures of octane and nonane at sub-monolayer coverage on graphite

M Castro, SM Clarke, A Inaba, RK Thomas, T Arnold

Physical Chemistry Chemical Physics

(2001)

3774

(doi: 10.1039/b102054o)

A new route to butane-1,2-diacetals and the development of alternative substitution patterns to facilitate differential protection of the products

SV Ley*, P Michel

Synlett

(2001)

2001

1793

(doi: 10.1055/s-2001-18087)

Identification of Tyr58 as the proton donor in the aspartate-α-decarboxylase reaction

SA Saldanha, LM Birch, ME Webb, BK Nabbs, F von Delft, AG Smith, C Abell

Chemical Communications

(2001)

1760

(doi: 10.1039/b106090m)

Vibrational relaxation of highly excited NCNO in collisions with He, Ar and N2

SMA Wright, IR Sims, IWM Smith

Physical Chemistry Chemical Physics

(2001)

2203

(doi: 10.1039/b100338k)

A supramolecular array assembled via the complementary binding properties of ruthenium( II ) and tin( IV ) porphyrins

BG Maiya, N Bampos, AA Kumar, N Feeder, JKM Sanders

New Journal of Chemistry

(2001)

797

(doi: 10.1039/b010148f)

The scope and limitation of the [1,4]-Sbenzyl participation and debenzylation in the stereochemically controlled synthesis of substituted thiolanes

J Eames, N Kuhnert, S Warren

JOURNAL OF THE CHEMICAL SOCIETY-PERKIN TRANSACTIONS 1

(2001)

1504

(doi: 10.1039/b102737a)

Stereocontrol in a one-pot procedure for anionic oxy-Cope rearrangement followed by intramolecular aldol reaction

AP Rutherford, CS Gibb, RC Hartley, JM Goodman

JOURNAL OF THE CHEMICAL SOCIETY-PERKIN TRANSACTIONS 1

(2001)

1051

(doi: 10.1039/b010138i)

A density functional theory study of hydroxyl and the intermediate in the water formation reaction on Pt

A Michaelides, P Hu

Journal of Chemical Physics

(2001)

114

513

(doi: 10.1063/1.1328746)

A Monte Carlo study of symmetry breaking of I₃^- in aqueous solution using a multistate diabatic Hamiltonian

CJ Margulis, DF Coker, RM Lynden-Bell

Journal of Chemical Physics

(2001)

114

367

(doi: 10.1063/1.1328757)

Electrostatic potential inside ionic solutions confined by dielectrics: a variational approach

R Allen, J-P Hansen, S Melchionna

Physical Chemistry Chemical Physics

(2001)

4177

(doi: 10.1039/b105176h)

The effects of distal ligand substitution on the copper( II )/ bis -(2,6-dipyrazol-1-ylpyridine) centre

NK Solanki, MA Leech, EJL McInnes, JP Zhao, FE Mabbs, N Feeder, JAK Howard, JE Davies, JM Rawson, MA Halcrow

Dalton Transactions

(2001)

2083

(doi: 10.1039/b103142m)

The kinetic profile of phthalazinium-2-dicyanomethanide 1,3-dipole with 2π-dipolarophiles: U-shaped dipolarophilic activity and classic type II dipole behaviour. Reaction rates and DFT calculations

RN Butler, AG Coyne, LA Burke

Journal of the Chemical Society Perkin Transactions 2

(2001)

1781

(doi: 10.1039/b103820f)

Rate constants and Arrhenius parameters for the reactions of OH radicals and Cl atoms with CF₃CH₂OCHF₂, CF₃CHClOCHF₂ and CF₃CH₂OCClF₂, using the discharge-flow/resonance fluorescence method

SD Beach, KM Hickson, IWM Smith, RP Tuckett

Physical Chemistry Chemical Physics

(2001)

3064

(doi: 10.1039/b103883b)

Entropic selectivity of microporous materials

D Goulding, S Melchionna, J-P Hansen

Physical Chemistry Chemical Physics

(2001)

1644

(doi: 10.1039/b009434j)

Alkyne–phosphinoalkyne coupling reactions on mixed-metal tungsten–cobalt centres; P–C(alkyne) bond cleavage versus P–C(alkyne) bond preservation