Reduction of chromium in ethylene polymerisation using bis(imido)chromium(vi) catalyst precursorsElectronic supplementary information available: Cartesian coordinate files of the computed stationary points. See http://www.rsc.org/suppdata/cc/b1/b110296f/

Well-defined ethylene polymerisation catalysts derived from bis(imido) chromium(VI) precursors

Journal of the Chemical Society Chemical Communications ◽

10.1039/c39950001709 ◽

1995 ◽

pp. 1709 ◽

Cited By ~ 46

Author(s):

Martyn P. Coles ◽

Christopher I. Dalby ◽

Vernon C. Gibson ◽

William Clegg ◽

Mark R. J. Elsegood

Keyword(s):

Chromium Vi ◽

Ethylene Polymerisation

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Vanadyl complexes bearing bi- and triphenolate chelate ligands: highly active ethylene polymerisation procatalystsElectronic supplementary information (ESI) available: selected spectroscopic and polymerisation data. See http://www.rsc.org/suppdata/cc/b4/b406783e/

Chemical Communications ◽

10.1039/b406783e ◽

2004 ◽

pp. 1954 ◽

Cited By ~ 58

Author(s):

Carl Redshaw ◽

Lee Warford ◽

Sophie H. Dale ◽

Mark R. J. Elsegood

Keyword(s):

Supplementary Information ◽

Highly Active ◽

Vanadyl Complexes ◽

Chelate Ligands ◽

Ethylene Polymerisation

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Nucleophilic attack at pyridine nitrogen and its use to access a novel mono-anionic ligand for iron-based ethylene polymerisation catalystsElectronic supplementary information (ESI) available: further characterisation data for 2a–5a. See http://www.rsc.org/suppdata/cc/b2/b203805f/

Chemical Communications ◽

10.1039/b203805f ◽

2002 ◽

pp. 1498-1499 ◽

Cited By ~ 25

Author(s):

Guy K. B. Clentsmith ◽

Vernon C. Gibson ◽

Peter B. Hitchcock ◽

Brian S. Kimberley ◽

Charles W. Rees

Keyword(s):

Supplementary Information ◽

Nucleophilic Attack ◽

Anionic Ligand ◽

Pyridine Nitrogen ◽

Iron Based ◽

Ethylene Polymerisation

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Chromium complexes bearing pyrrolide-imine N,N-chelate ligands: synthesis, structures and ethylene polymerisation behaviourElectronic supplementary information (ESI) available: a plot of the molecular structure of 3a. See http://www.rsc.org/suppdata/dt/b2/b204568k/

Journal of the Chemical Society Dalton Transactions ◽

10.1039/b204568k ◽

2002 ◽

pp. 4017-4023 ◽

Cited By ~ 46

Author(s):

Vernon C. Gibson ◽

Claire Newton ◽

Carl Redshaw ◽

Gregory A. Solan ◽

Andrew J. P. White ◽

...

Keyword(s):

Molecular Structure ◽

Supplementary Information ◽

Chromium Complexes ◽

Chelate Ligands ◽

Ethylene Polymerisation

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Experimental and theoretical studies of gas phase NO3 and OH radical reactions with formaldehyde, acetaldehyde and their isotopomersElectronic supplementary information (ESI) available: program package FACSIMILE for simulation of the complex set of reactions and the kinetics of the reactor system. Kinetic data from the acetaldehyde studies, the spectral ranges and the compounds included in the subtraction procedures, and a full report of the statistical analyses. Calculated energies of the reactants, intermediate stationary points of the potential energy surface, and the products. Calculated vibrational wavenumbers of the reactants and transition states. See http://www.rsc.org/suppdata/cp/b2/b211234p/

Physical Chemistry Chemical Physics ◽

10.1039/b211234p ◽

2003 ◽

Vol 5 (9) ◽

pp. 1790-1805 ◽

Cited By ~ 48

Author(s):

Barbara D'Anna ◽

Vebjørn Bakken ◽

Jon Are Beukes ◽

Claus J. Nielsen ◽

Katarzyna Brudnik ◽

...

Keyword(s):

Gas Phase ◽

Energy Surface ◽

Stationary Points ◽

Supplementary Information ◽

Theoretical Studies ◽

Oh Radical ◽

Spectral Ranges ◽

Kinetics Of ◽

Experimental And Theoretical Studies ◽

Vibrational Wavenumbers

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The influence of hydrogen bonding interactions on the C–H bond activation step in class I ribonucleotide reductasesElectronic supplementary information (ESI) available: Energies and structures of stationary points for studied reactions. See http://www.rsc.org/suppdata/ob/b2/b210536p/

Organic & Biomolecular Chemistry ◽

10.1039/b210536p ◽

2003 ◽

Vol 1 (4) ◽

pp. 692-699 ◽

Cited By ~ 15

Author(s):

Hendrik Zipse

Keyword(s):

Hydrogen Bonding ◽

Bond Activation ◽

Class I ◽

Stationary Points ◽

Supplementary Information ◽

Hydrogen Bonding Interactions

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Matrix isolation FTIR and molecular orbital study of E and Z acetaldoxime monomersElectronic supplementary information (ESI) available: Internal coordinates for the Z and E isomers, calculated barriers for the rotation of methyl groups and the relative energies of the relevant stationary points for acetaldoxime. See http://www.rsc.org/suppdata/cp/b2/b203240f/

Physical Chemistry Chemical Physics ◽

10.1039/b203240f ◽

2002 ◽

Vol 4 (14) ◽

pp. 3289-3296 ◽

Cited By ~ 25

Author(s):

Agnieszka Andrzejewska ◽

Leszek Lapinski ◽

Igor Reva ◽

Rui Fausto

Keyword(s):

Molecular Orbital ◽

Matrix Isolation ◽

Stationary Points ◽

Supplementary Information ◽

Methyl Groups ◽

Molecular Orbital Study ◽

Internal Coordinates ◽

Orbital Study

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The pyrophosphate-assisted reduction of chromium(vi) by manganese(ii) and its reverse reactionElectronic supplementary information (ESI) available: derivation of the theoretical rate laws, apparent kinetic orders of Mn(ii) at various initial concentrations of Cr(vi) and at various temperatures, initial rates at various concentrations of sodium perchlorate, parameters a and b at various temperatures, and initial rates at various temperatures. See http://www.rsc.org/suppdata/nj/b1/b104573n/

New Journal of Chemistry ◽

10.1039/b104573n ◽

2001 ◽

Vol 25 (11) ◽

pp. 1438-1446 ◽

Cited By ~ 9

Author(s):

Joaquin F. Perez-Benito ◽

Conchita Arias

Keyword(s):

Sodium Perchlorate ◽

Supplementary Information ◽

Rate Laws ◽

Chromium Vi

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Trends in alkyl substituent effects on nucleophilic reactions of carbonyl compounds: Gas phase reactions between ammonia and R1R2COCH3+ oxonium ionsElectronic supplementary information (ESI) available: proton affinities, geometries and energies of optimised structures, structures of the stationary points and a plot of experimental and RRKM ln(kae/ksub) against a-stabilisation constants. See http://www.rsc.org/suppdata/ob/b2/b209955c/

Organic & Biomolecular Chemistry ◽

10.1039/b209955c ◽

2003 ◽

Vol 1 (4) ◽

pp. 705-713 ◽

Cited By ~ 5

Author(s):

Lihn Bache-Andreassen ◽

Einar Uggerud

Keyword(s):

Gas Phase ◽

Carbonyl Compounds ◽

Substituent Effects ◽

Alkyl Substituent ◽

Stationary Points ◽

Supplementary Information ◽

Proton Affinities ◽

Gas Phase Reactions ◽

Nucleophilic Reactions

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Synthesis and molecular modelling studies of resorcin[4]arene-capped porphyrinsElectronic supplementary information (ESI) available: Benzene-d6 shifts of compound 7 compared with those of component units, details on the new parameters added to heme29 and cartesian coordinate files of lowest-energy conformations of 3, 5 and 7 (benzene inside) on the molecular modelling studies (pdb and arc files). See http://www.rsc.org/suppdata/ob/b3/b303741j/See Ref. 1.

Organic & Biomolecular Chemistry ◽

10.1039/b303741j ◽

2003 ◽

Vol 1 (17) ◽

pp. 3131 ◽

Cited By ~ 8

Author(s):

Bruno Botta ◽

Paola Ricciardi ◽

Carlo Galeffi ◽

Maurizio Botta ◽

Andrea Tafi ◽

...

Keyword(s):

Molecular Modelling ◽

Supplementary Information ◽

Molecular Modelling Studies ◽

Modelling Studies ◽

Cartesian Coordinate

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