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1

Radical Anions from Urea-type Carbonyls: Radical Cyclizations and Cyclization Cascades

Huang, Huan-Ming, McDouall, Joseph, Procter, David John

Journal:

Angewandte Chemie International Edition

Year:

2018

Language:

english

File:

PDF, 3.78 MB

english, 2018

2

Chapter 3. Theoretical organic chemistry

McDouall, J. J. W.

Journal:

Annual Reports Section "B" (Organic Chemistry)

Year:

1992

Language:

english

File:

PDF, 714 KB

english, 1992

3

Trifluoromethyl sulfoxides: New reagents for metalâfree CâH trifluoromethylthiolation

Wang, Dong, Carlton, C Grace, Tayu, Masanori, McDouall, J J.W., Perry, Gregory J.P., Procter, David John

Journal:

Angewandte Chemie International Edition

Year:

2020

File:

PDF, 2.06 MB

2020

4

A simple MC SCF perturbation theory: Orthogonal valence bond Møller-Plesset 2 (OVB MP2)

Joseph J.W. McDouall, Kathryn Peasley, Michael A. Robb

Journal:

Chemical Physics Letters

Year:

1988

Language:

english

File:

PDF, 681 KB

english, 1988

5

Transition structure for the epoxidation of alkenes with peroxy acids. A theoretical study

Bach, Robert D., Owensby, Amy L., Gonzalez, Carlos, Schlegel, H. Bernard, McDouall, Joseph J. W.

Journal:

Journal of the American Chemical Society

Year:

1991

Language:

english

File:

PDF, 334 KB

english, 1991

6

Journal of His Expedition across the Centre of Australia, from Spencer Gulf on the South to Latitude 18° 47′ on the North

J. McDouall Stuart

Journal:

Proceedings of the Royal Geographical Society of London

Year:

1860-1861

Language:

english

File:

PDF, 744 KB

english, 1860-1861

7

Explorations from Adelaide across the Continent of Australia

J. McDouall Stuart

Journal:

Proceedings of the Royal Geographical Society of London

Year:

1862-1863

Language:

english

File:

PDF, 151 KB

english, 1862-1863

8

Spectroscopic Properties and Electronic Structure of the Cycloheptatrienyl Molybdenum Alkynyl Complexes [Mo(C≡CR)(Ph 2 PCH 2 CH 2 PPh 2 )(η-C 7 H 7 )] n + ( n = 0 or 1; R = Bu t , Fc, CO 2 Me, or C 6 H 4

Brown, Neil J., Collison, David, Edge, Ruth, Fitzgerald, Emma C., Helliwell, Madeleine, Howard, Judith A. K., Lancashire, Hannah N., Low, Paul J., McDouall, Joseph J. W., Raftery, James, Smith, Charle

Journal:

Organometallics

Year:

2010

Language:

english

File:

PDF, 4.38 MB

english, 2010

9

Origin of Impurities Formed in the Polyurethane Production Chain. 1. Conditions for Chlorine Transfer from an Aryl Isocyanide Dichloride Byproduct

Callison, June, Edge, Ruth, de Cuba, Kimberly R., Carr, Robert H., McDouall, Joseph J. W., Collison, David, McInnes, Eric J. L., van der Borden, Willem, van der Velde, Klaas, Winfield, John M., Lennon

Journal:

Industrial & Engineering Chemistry Research

Year:

2012

Language:

english

File:

PDF, 1.46 MB

english, 2012

10

Nickel(II) and Palladium(II) Complexes of Azobenzene-Containing Ligands as Dichroic Dyes

Blackburn, Octavia A., Coe, Benjamin J., Fielden, John, Helliwell, Madeleine, McDouall, Joseph J. W., Hutchings, Michael G.

Journal:

Inorganic Chemistry

Year:

2010

Language:

english

File:

PDF, 2.88 MB

english, 2010

11

Biocatalytic Dynamic Kinetic Resolution for the Synthesis of Atropisomeric Biaryl N-Oxide Lewis Base Catalysts

Staniland, Samantha, Adams, Ralph W., McDouall, Joseph J. W., Maffucci, Irene, Contini, Alessandro, Grainger, Damian M., Turner, Nicholas J., Clayden, Jonathan

Journal:

Angewandte Chemie International Edition

Year:

2016

Language:

english

File:

PDF, 982 KB

english, 2016

12

Advantageous 3D Ordering of π-Conjugated Systems: A New Approach Towards Efficient Charge Transport in any Direction

H. Pang, F. Vilela, P. J. Skabara, J. J. W. McDouall, D. J. Crouch, T. D. Anthopoulos, D. D. C. Bradley, D. M. de Leeuw, P. N. Horton, M. B. Hursthouse

Journal:

Advanced Materials

Year:

2007

Language:

english

File:

PDF, 335 KB

english, 2007

13

Biocatalytic Desymmetrization of an Atropisomer with both an Enantioselective Oxidase and Ketoreductases

Bo Yuan, Abigail Page, Christopher P. Worrall, Dr. Franck Escalettes, Dr. Simon C. Willies, Dr. Joseph J. W. McDouall, Prof. Nicholas J. Turner, Prof. Jonathan Clayden

Journal:

Angewandte Chemie

Year:

2010

Language:

english

File:

PDF, 420 KB

english, 2010

14

Biocatalytic Desymmetrization of an Atropisomer with both an Enantioselective Oxidase and Ketoreductases

Bo Yuan, Abigail Page, Christopher P. Worrall, Dr. Franck Escalettes, Dr. Simon C. Willies, Dr. Joseph J. W. McDouall, Prof. Nicholas J. Turner, Prof. Jonathan Clayden

Journal:

Angewandte Chemie International Edition

Year:

2010

Language:

english

File:

PDF, 439 KB

english, 2010

15

Controlling the Conformational Changes in Donor–Acceptor [4]-Dendralenes through Intramolecular Charge-Transfer Processes

Alexander L. Kanibolotsky, John C. Forgie, Greg J. McEntee, M. Munsif A. Talpur, Peter J. Skabara, Thomas D. J. Westgate, Joseph J. W. McDouall, Michael Auinger, Simon J. Coles, Michael B. Hursthouse

Journal:

Chemistry - A European Journal

Year:

2009

Language:

english

File:

PDF, 923 KB

english, 2009

16

Influence of the N-Bridging Ligand on Magnetic Relaxation in an Organometallic Dysprosium Single-Molecule Magnet

Richard A. Layfield, Joseph J. W. McDouall, Scott A. Sulway, Floriana Tuna, David Collison, Richard E. P. Winpenny

Journal:

Chemistry - A European Journal

Year:

2010

Language:

english

File:

PDF, 349 KB

english, 2010

17

Tripodal Thiols as Ligands for Molecular Magnets: Very Strong Antiferromagnetic Exchange Interactions in Vanadium(III) Clusters

Luke J. Batchelor, Emma Fitzgerald, Dr. Joanna Wolowska, Dr. Joseph J. W. McDouall, Prof. Eric J. L. McInnes

Journal:

Chemistry - A European Journal

Year:

2010

Language:

english

File:

PDF, 387 KB

english, 2010

18

Transition structure in a diabatic surface formalism

Fernando Bernardi, Joseph J.W. McDouall, Michael A. Robb

Journal:

Journal of Computational Chemistry

Year:

1987

Language:

english

File:

PDF, 1.10 MB

english, 1987

19

Variational biorthogonal valence bond descriptions of 1,3-dipoles

Nathaniel O. J. Malcolm, Joseph J. W. McDouall

Journal:

Journal of Computational Chemistry

Year:

1994

Language:

english

File:

PDF, 439 KB

english, 1994

20

A variational biorthogonal valence bond method

Nathaniel O. J. Malcolm, Joseph J. W. McDouall

Journal:

Journal of Computational Chemistry

Year:

1994

Language:

english

File:

PDF, 497 KB

english, 1994

21

Measurement of relative regional tumor blood flow in mice by deuterium NMR imaging

Jeffrey L. Evelhoch, Jacqueline B. Larcombe McDouall, James Mattiello, Nicholas E. Simpson

Journal:

Magnetic Resonance in Medicine

Year:

1992

Language:

english

File:

PDF, 743 KB

english, 1992

22

Quantitative MRI of the Prostate and Uterus in Monkeys

John C. Waterton, Jacqueline B. Larcombe-Mcdouall, Diane Miller

Journal:

Magnetic Resonance in Medicine

Year:

1992

Language:

english

File:

PDF, 878 KB

english, 1992

23

Continuous measurement of cell volume changes in perfused rat salivary glands by proton NMR

Jacky B. Larcombe-McDouall, Yoshiteru Seo, Martin C. Steward

Journal:

Magnetic Resonance in Medicine

Year:

1994

Language:

english

File:

PDF, 760 KB

english, 1994

24

A 31P NMR investigation into the effects of repeated vascular occlusion on uterine metabolites, intracellular pH and force, in vivo

Norma Harrison, Susan Wray, Jacky B. Larcombe-Mcdouall

Journal:

NMR in Biomedicine

Year:

1995

Language:

english

File:

PDF, 542 KB

english, 1995

25

An intrinsic localization procedure for active CAS SCF orbitals

Joseph J.W. McDouall, Michael A. Robb

Journal:

Chemical Physics Letters

Year:

1986

Language:

english

File:

PDF, 514 KB

english, 1986

26

An efficient algorithm for the approximate location of transition structures in a diabatic surface formalism

Joseph J.W. McDouall, Michael A. Robb, F. Bernardi

Journal:

Chemical Physics Letters

Year:

1986

Language:

english

File:

PDF, 559 KB

english, 1986

27

The transformation of CAS SCF wavefunctions to valence bond space

Joseph J.W. McDouall, M.A. Robb

Journal:

Chemical Physics Letters

Year:

1987

Language:

english

File:

PDF, 450 KB

english, 1987

28

A simple scaling for combining multiconfigurational wavefunctions with density functionals

Nathaniel O.J Malcolm, Joseph J.W McDouall

Journal:

Chemical Physics Letters

Year:

1998

Language:

english

File:

PDF, 127 KB

english, 1998

29

Alloproliferation of purified CD4+ T cells to adult human heart endothelial cells, and study of second-signal requirements

R. M. MCDOUALL, C. S. PAGE, S. HAFIZI, M. H. YACOUB, M. L. ROSE

Journal:

Year:

1996

Language:

english

File:

PDF, 486 KB

english, 1996

30

Structure and dynamics of dicyandiamide: A theoretical study

Robert D. Bach, Joseph J. W. McDouall, Amy L. Owensby, H. Bernhard Schlegel, Joseph W. Holubka, James C. Ball

Journal:

Journal of Physical Organic Chemistry

Year:

1991

Language:

english

File:

PDF, 667 KB

english, 1991

31

Continuous fluorometric measurement of intracellular pH and Ca2+in perfused salivary gland and pancreas

J. T. Seo, M. C. Steward, J. B. Larcombe-McDouall, L. J. Cook, R. M. Case

Journal:

Pflügers Archiv European Journal of Physiology

Year:

1994

Language:

english

File:

PDF, 892 KB

english, 1994

32

Biorthogonal valence bond descriptions of electronic structure

Joseph J. W. McDouall

Journal:

Theoretical Chemistry Accounts: Theory, Computation, and Modeling (Theoretica Chimica Acta)

Year:

1992

Language:

english

File:

PDF, 785 KB

english, 1992

33

Dynamic correlation for biorthogonal valence bond reference states

Joseph J. W. McDouall

Journal:

Theoretical Chemistry Accounts: Theory, Computation, and Modeling (Theoretica Chimica Acta)

Year:

1993

Language:

english

File:

PDF, 533 KB

english, 1993

34

The in vivo relationship between blood flow, contractions, pH and metabolites in the rat uterus

Jacky B. Larcombe-McDouall, Norma Harrison, S. Wray

Journal:

Pflügers Archiv European Journal of Physiology

Year:

1998

Language:

english

File:

PDF, 355 KB

english, 1998

35

A study of competitive secondary dissociation in the thermal decomposition of ethynylsilane

J.S. Francisco, C. Kurz, J.J.W. McDouall

Journal:

Chemical Physics Letters

Year:

1989

Language:

english

File:

PDF, 325 KB

english, 1989

36

Transition state dynamics of O(3P) + H2S reactive scattering

Z.Z. Zhu, J.J.W. McDouall, D.J. Smith, R. Grice

Journal:

Chemical Physics Letters

Year:

1992

Language:

english

File:

PDF, 303 KB

english, 1992

37

A theoretical and experimental study of the HPCl radical: the Ã2A′→X̃2A″ visible emission spectrum

M.J. Bramwell, D.M. Rogers, J.J.W. McDouall, J.C. Whitehead

Journal:

Chemical Physics Letters

Year:

2000

Language:

english

File:

PDF, 134 KB

english, 2000

38

A comparison of the laryngeal mask airway with the facemask and oropharyngeal airway for manual ventilation by first responders in children

A. E. Blevin, S. F. McDouall, J. A. Rechner, T. A. Saunders, V. S. Barber, J. D. Young, D. G. Mason

Journal:

Year:

2009

Language:

english

File:

PDF, 159 KB

english, 2009

39

Increased cyclosporine sensitivity of T cells from cord blood compared with those from the adult

R. M. MCDOUALL, A. J. SUITTERS, H. SMITH, M. H. YACOUB, M. L. ROSE

Journal:

Clinical & Experimental Immunology

Year:

1994

Language:

english

File:

PDF, 2.39 MB

english, 1994

40

In vivo pH and metabolite changes during a single contraction in rat uterine smooth muscle

Jacky Larcombe-McDouall, Naomi Buttell, Norma Harrison, Susan Wray

Journal:

The Journal of Physiology

Year:

1999

Language:

english

File:

PDF, 275 KB

english, 1999

41

Synthesis, spectroscopy and electronic structure of the vinylidene and alkynyl complexes [W(CCHR)(dppe)(η-C7H7)]+ and [W(CCR)(dppe)(η-C7H7)]n+ (n = 0 or 1)

Lancashire, Hannah N., Brown, Neil J., Carthy, Laura, Collison, David, Fitzgerald, Emma C., Edge, Ruth, Helliwell, Madeleine, Holden, Mark, Low, Paul J., McDouall, Joseph J. W.

Journal:

Dalton Transactions

Year:

2011

Language:

english

File:

PDF, 437 KB

english, 2011

42

Theoretical study of oxygen atom transfer. The role of electron correlation

Bach, Robert D., McDouall, Joseph J. W., Owensby, Amy L., Schlegel, H. Bernhard

Journal:

Journal of the American Chemical Society

Year:

1990

Language:

english

File:

PDF, 428 KB

english, 1990

43

An ab initio study of hydrogen abstraction from propane by the CN radical

Joseph J.W. McDouall

Journal:

Journal of Molecular Structure: THEOCHEM

Year:

1992

Language:

english

File:

PDF, 486 KB

english, 1992

44

Assessment of the Langevin dipoles solvation model for Hartree-Fock wavefunctions

Nathaniel O.J. Malcolm, Joseph J.W. McDouall

Journal:

Journal of Molecular Structure: THEOCHEM

Year:

1996

Language:

english

File:

PDF, 678 KB

english, 1996

45

Preface

I.H Hillier, J.J.W McDouall

Journal:

Journal of Molecular Structure: THEOCHEM

Year:

2000

Language:

english

File:

PDF, 31 KB

english, 2000

46

An efficient string-based truncation scheme for MCSCF calculations

David M. Rogers, Joseph J.W. McDouall

Journal:

Journal of Molecular Structure: THEOCHEM

Year:

1998

Language:

english

File:

PDF, 114 KB

english, 1998

47

On the choice of active space orbitals in MCSCF calculations

David M. Rogers, Claire Wells, Melanie Joseph, Vanessa J. Boddington, Joseph J.W. McDouall

Journal:

Journal of Molecular Structure: THEOCHEM

Year:

1998

Language:

english

File:

PDF, 115 KB

english, 1998

48

Reactivity of Lewis Acid Activated Diaza- and Dithiaboroles in Electrophilic Arene Borylation

Solomon, S. A., Del Grosso, A., Clark, E. R., Bagutski, V., McDouall, J. J. W., Ingleson, M. J.

Journal:

Organometallics

Year:

2012

Language:

english

File:

PDF, 1.31 MB

english, 2012

49

Electronic and Magnetic Properties of Kremer’s tris-Hydroxo Bridged Chromium Dimer: A Challenge for DFT

Bennie, Simon J., Collison, David, McDouall, Joseph J. W.

Journal:

Journal of Chemical Theory and Computation

Year:

2012

Language:

english

File:

PDF, 4.33 MB

english, 2012

50

Isolation, Culture, and Characterisation of MHC Class II-Positive Microvascular Endothelial Cells from the Human Heart

Rhoda M. McDouall, Magdi Yacoub, Marlene L. Rose

Journal:

Microvascular Research

Year:

1996

Language:

english

File:

PDF, 236 KB

english, 1996

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