10,11-Dihydrodiindeno[1,2-b:2',1'-d]thiophene (2008)
Coles, Simon J., Hursthouse, Michael B., Skabara, Peter J., Afonina, Irina, Kanibolotsky, Alexander
trans-Dichloro-bis(metronidazole)-platinum(II) (2008)
Coles, Simon J., Hursthouse, Michael B., Maurya, M. R., Azam, A.
N-(4-ethoxyphenyl)acetamide (2008)
Huth, Susanne L., Threlfall, Terry L., Hursthouse, Michael B., Coles, Simon J.
N-(4-methoxyphenyl)acetamide (2008)
Huth, Susanne L., Threlfall, Terry L., Hursthouse, Michael B., Coles, Simon J.
N-(4-methylphenyl)acetamide (2008)
Huth, Susanne L., Threlfall, Terry L., Hursthouse, Michael B., Coles, Simon J.
This presentation begins by outlining the changing nature of the exchange of chemical information and the new opportunities that are provided by the new generation of tools and services available on...
tetrakis(Pyridine)-copper(i), hexafluorophosphate (2008)
Coles, Simon J., Hursthouse, Michael B., Sengul, Abdurrahaman, Altin, Safinaz, Kurt, Ozgur
Coles, Simon J., Hursthouse, Michael B., Stephenson, Richard A., Cliff, Pete, Lyon, Elizabeth J., Patel, Manjula, ...
Recently the funding councils in the UK stated that ‘the data underpinning the published results of publicly-funded research should be made available as widely and rapidly as possible’. Thirty...
10,11-Dihydrodiindeno[1,2-b:2′,1′-d]thiophene (2008)
Irina Afonina, Simon J. Coles, Michael B. Hursthouse, Alexander Kanibolotsky, Peter J. Skabara
The title compound, C18H12S, comprises five fused rings forming an essentially planar molecule, with a total puckering amplitude (Q) of 0.032 Å and a maximum deviation from the mean plane...
Coe, Benjamin J., Fitzgerald, Emma C., Helliwell, Madeleine, Brunschwig, Bruce S., Fitch, Anthony G., Harris, James A., ...
We have prepared three new heterobimetallic complexes containing electron-donating trans-{RuIICl(pdma)2}+ [pdma = 1,2-phenylenebis(dimethylarsine)] centers linked to electron-deficient...
Martin, Eddy, Spendley, Claire, Mountford, Andrew J., Coles, Simon J., Horton, Peter N., Hughes, David L., ...
Treatment of (C6F5)2Zn(toluene) with 2 equiv of a series of benzonitrile or pyridine derivatives yielded the complexes (C6F5)2Zn(L)2 (where L = benzonitrile, 4-(phenyl)benzonitrile,...
eCrystals Federation: open repositories for open science (2007)
Lyon, Liz, Coles, Simon J., Patel, Manjula
This presentation will describe the background of the eCrystals Federation, which is based on eBank foundations, and which, in partnership with OAI-ORE, will implement a federation of open data...
Based on the e-Bank-UK (http://www.ukoln.ac.uk/projects/ebank-uk) and Repository for the Laboratory, R4L (http://r4l.eprints.org) projects, a working model for a scientific data capture, management,...
Coles, Simon J, Davies, David B, Hursthouse, Michael B, Huth, Susanne L, Kılıç, Adem, Light, Mark E, ...
Abstract Background The crystal structure of 2,2-trimethylenedioxy-4,4,6,6-tetrachlorocyclo triphosphazene has been determined at 120, 274 and 293 K. The result at 293 K confirms the room temperature...
2-(5-Bromo-4H-1,4-thiophen-2 -ylmethylene)-3-(5-bromo-thiophen-2 -ylmethylene)-succinaldehyde (2007)
Bis(2,4,6trimethybenzyl)pyridine-2,6-dicarboxylate (2007)
Cheesewright, J.E., Grossel, M.G., Grossel, M.C., Hursthouse, Michael B., Coles, Simon J.
1-((E)-3-Phenyl-propenyl)-pyrrolidine (2007)
Tomkinson, N, Coles, Simon J., Hursthouse, Michael B., Coles, Simon J.
The EPSRC National Crystallography Service – a valuable extension of your home laboratory (2007)
Coles, Simon J., Horton, Peter N., Hursthouse, Michael B., Male, Louise, Stephenson, Richard A., Clegg, William, ...
The UK National Crystallography Service (NCS) is an amalgamation of resources at two centres; Southampton Chemical Crystallography Group and Daresbury SRS (Newcastle component). This service provides...
2,2-trimethylenedioxy-4,4,6,6-tetrachlorocyclotriphosphazene (2007)
Uslu, A., Odlyha, M., Kilic, A., Shaw, R.A., Davies, David B., Light, Mark E., ...
2,2-trimethylenedioxy-4,4,6,6-tetrachlorocyclotriphosphazene (2007)
Kilic, A., Odlyha, M., Uslu, A., Davies, David B., Shaw, R.A., Light, Mark E., ...
2,2-trimethylenedioxy-4,4,6,6-tetrachlorocyclotriphosphazene (2007)
Uslu, A., Odlyha, M., Kilic, A., Shaw, R.A., Davies, David B., Light, Mark E., ...
2-Hydroxy-benzoic acid nicotinamide (2007)
Berry, D, Blagden, N, Coles, Simon J., Hursthouse, Michael B., Coles, Simon J.
1,2,4-Triphenyl-but-3-yne-1,2-diol (2007)
Knight, D.W., Coles, Simon J., Hursthouse, Michael B., Coles, Simon J.
2007src0011 306-725-1-A (2007)
Shaw, R. A., Davies, David B., Kilic, A., Yesilot, S, Coles, Simon J., Hursthouse, Michael B.
Tandem Michael/Michael reactions mediated by phosphines or aryl thiolates (2007)
Brown, Paul M., Käppel, Nina, Murphy, Patrick J., Coles, Simon J., Hursthouse, Michael B.
Tri-n-butyl phosphine was found to effect tandem Michael/Michael cyclisations leading to the formation of cyclopentenes and cyclohexenes in good yields, whilst p-TolSH in conjunction with a catalytic...
10,11-Dihydrodiindeno[1,2-b:2',1'-d]-thiophene (2007)
Afonina, Irina, Coles, Simon J., Hursthouse, Michael B., Kanibolotsky, Alexander, Skabara, Peter J.
The title compound, C18H12S, comprises five fused rings forming an essentially planar molecule, with a total puckering amplitude (Q) of 0.032 Å and a maximum deviation from the mean plane of 0.014...
Five-coordinate Pd(II) orthometallated triarylphosphite complexes (2007)
Bedford, Robin B., Betham, Michael, Butts, Craig P., Coles, Simon J., Cutajar, Marica, Gelbrich, Thomas, ...
The reaction of the orthopalladated triarylphosphite complexes[{Pd(mu-Cl){kappa(2)-P,C-P(OC6H2-2,4- R-2)-(OC6H(3)-2,4-R-2)}(2)] (R = H, Bu-t) with bis(2-diphenylphosphinoethyl)phenylphosphine leads...
Poly(3,4-ethylenediselena)thiophene - the selenium equivalent of PEDOT (2007)
Pang, Hao, Skabara, Peter J., Gordeyev, Sergey, McDouall, Joseph J.W., Coles, Simon J., Hursthouse, Michael B.
The first synthesis of the selenium analogue of EDOT, together with its electrochemical polymerization and redox and electronic properties of the resulting polymer,...
Capturing and sharing chemistry research data (2007)
Recent developments in scientific instrument hardware and a vast increase in computational processing power have seen an exponential increase in the rate and quantity of research data produced. This...
A spiro to ansa rearrangement in cyclotriphosphazene derivatives (2007)
Beşli, Serap, Coles, Simon J., Davies, David B., Hursthouse, Michael B., Kılıç, Adem, Shaw, Robert A.
Nucleophilic substitution reactions of cyclotriphosphazene derivatives having five-membered spiro rings, N3P3Cl4[O(CH2)2X] (X = NH or O) with alkoxides (of tetraethylene glycol and some...
Coles, Simon J., Davies, David B., Eaton, Robert J., Hursthouse, Michael B., Kılıç, Adem, Shaw, Robert A., ...
Derivatives of the tri-spirane pentaerythritoxy-cyclophosphazene compound, 1, have been used to investigate the stereogenic properties of spiranes combined with four equivalent conventional centres...
Day, Joanna K., Bresner, Chrisopher, Fallis, Ian A., Ooi, Li-Ling, Watkin, David J., Coles, Simon J., ...
A simple, one-step synthesis of multinuclear Lewis acids can be driven with high selectivity towards either macrocyclic or polymeric arrays by appropriate choice of backbone framework.
eCrystals: A Route for Open Access to Small Molecule Crystal Structure Data. (2006)
Coles, Simon J., Hursthouse, Michael B., Frey, Jeremy G., Milsted, Andrew J., Carr, Leslie A., Koch, Traugott, ...
Recently the funding councils in the UK stated that ‘the data underpinning the published results of publically-funded research should be made available as widely and rapidly as possible’. Thirty...
De La Torre, Jose M., Coles, Simon J., Hursthouse, Michael B., Cobo, J., Portilla, J.
The work presented in this study compares hydrogen bonding motifs in two families of nitrogen based heterocycle compounds, fused pyrazolo-pyrimidines and pyrazolo-pyridines. Both families have in...
Bartlett, Stewart W, Coles, Simon J, Davies, David B, Hursthouse, Michael B, Ibisoglu, Hanife, Kilic, Adem, ...
A series of compounds of the N3P3Cl(6-n)(NHBut)n family (where n = 0, 1, 2, 4 and 6) are presented, and their molecular parameters are related to trends in physical properties, which provides insight...
An e-Science environment for service crystallography - from submission to dissemination (2006)
Coles, Simon J., Frey, Jeremy G., Hursthouse, Michael B., Light, Mark E., Milsted, Andrew J., Carr, Leslie A., ...
The UK National Crystallography Service (NCS) has developed a prototype e-Science infrastructure for the provision of a small molecule crystallography service from sample receipt to results...
An e-Science environment for service crystallography - from submission to dissemination (2006)
Coles, Simon J., Frey, Jeremy G., Hursthouse, Michael B., Light, Mark E., Milsted, Andrew J., Carr, Leslie A., ...
The UK National Crystallography Service (NCS) has developed a prototype e-Science infrastructure for the provision of a small molecule crystallography service from sample receipt to results...
An e-Science environment for service crystallography - from submission to dissemination (2006)
Coles, Simon J., Frey, Jeremy G., Hursthouse, Michael B., Light, Mark E., Milsted, Andrew J., Carr, Leslie A., ...
The UK National Crystallography Service (NCS) has developed a prototype e-Science infrastructure for the provision of a small molecule crystallography service from sample receipt to results...
An e-Science environment for service crystallography - from submission to dissemination (2006)
Coles, Simon J., Frey, Jeremy G., Hursthouse, Michael B., Light, Mark E., Milsted, Andrew J., Carr, Leslie A., ...
The UK National Crystallography Service (NCS) has developed a prototype e-Science infrastructure for the provision of a small molecule crystallography service from sample receipt to results...
Coles, Simon J., Frey, Jeremy G., Hursthouse, Michael B., Milsted, Andrew J., Carr, Leslie A., Gutteridge, Christopher J., ...
Coles, Simon J., Frey, Jeremy G., Hursthouse, Michael B., De Roure, David, Mills, Hugo R., Meacham, Ken E.
An e-science environment for service crystallographysfrom submission to dissemination (2006)
Coles, Simon J., Frey, Jeremy G., Hursthouse, Michel B., Light, Mark E., Milsted, Andrew J., Carr, Leslie A., ...
The U.K. National Crystallography Service (NCS) has developed a prototype e-science infrastructure for the provision of a small molecule crystallography service from sample receipt to results...