1995 Research Publications

Crystallography Centre

Books and Chapters

Hall, S.R., King, G.S.D. and Stewart, J.M. XTAL3.4: Users Manual, Perth, Lamb Print (1995)

Journal Articles

Abrahams, C.T., Deacon, G.B., Forsyth, C.M., Patalinghug, W.C., Skelton, B.W. and White, A.H. Organoamido- and aryloxo-lanthanoids. XII. The coordination chemistry of bis(2-phenylindol-l-yl)ytterbium(II), and the X-ray crystal structures of Yb(pin)2(diglyme)(thf) and [Yb(pin)2dme)]2 (pin = 2-phenylindol-l-yl, diglyme = bis(2-methoxyethyl) ether, thf = tetrahydrofuran, dme = 1,2-dimethoxyethane), Australian Journal of Chemistry, 48: pp 1933-1947 (1995)

Allen, F.H., Barnard, J.M., Cook, A.P.F. and Hall, S.R. The molecular information file (MIF): core specifications of a new standard format for chemical data, Journal of Chemical Information and Computer Science, 35: pp 412-427 (1995)

Anderson, P.A., Treadway, J.A., White, A.H., Deacon, G.B., Haarmann, K.H., Keene, F.R., Meyer, T.J., Reitsma, D.A., Skelton, B.W., Strouse, G.F. and Thomas, N.C. Designed synthesis of mononuclear tris(heteroleptic) ruthenium complexes containing bidentate polypyridyl ligands, Inorganic Chemistry, 34: pp 6145-6157 (1995)

Bailey, T.S., Bremner, J.B., Pelosi, L., Skelton, B.W. and White, A.H. Synthesis and X-ray crystal structure of 8,9-dimethoxy-4-methyl-3-phenyl-2,3,5,6-tetrahydropyrrolo[2,1-a]isoquinolinium iodide, Australian Journal of Chemistry, 48: pp 1437-1445 (1995)

Boutchard, C.L., Hitchman, M.A., Skelton, B.W. and White, A.H. Crystal structure and electronic spectrum of the distorted tetrahedral CuCl42- ion in bis(2-aminopyridinium) tetrachlorocuprate(II) and comparison with the tetragonally elongated octahedral complex bis(2-aminopyrimidinium)tetrachlorocopper(II), Australian Journal of Chemistry, 48: pp 771-782 (1995)

Bruce, M.I., Hinchliffe, J.R., Skelton, B.W. and White, A.H. Cluster chemistry. XCLX. An unusual hydrocarbon-cluster bonding mode in Ru3(m3-2h1,2h3-C14H17Me)(m-CO)(CO)7, obtained from Ru3(CO)12 and 1,5,9-trimethyl-cyclododeca-1,5,9-triene, Australian Journal of Chemistry, 48: pp 1651-1657 (1995)

Bruce, M.I., Hinchliffe, J.R., Skelton, B.W. and White, A.H. Cluster chemistry. Part 97. Some unusual complexes obtained from reactions of Ru3(m-dppm)CO)10 and C7 or C6 hydrocarbons., Journal of Organometallic Chemistry, 495: pp 141-148 (1995)

Bruce, M.I., Zaitseva, N.N., Skelton, B.W. and White, A.H. A new bow-tie: synthesis and X-ray structure of Co2Ru3(h5-h2h2-PhC2C2Ph)(CO)14, which shows a remarkable and unusual asymmetry in the solid state, Polyhedron, 14: pp 2647-2652 (1995)

Bruce, M.I., Low, P.J., Skelton, B.W., Tiekink, E.R.T., Werth, A. and White, A.H.Cyclopentadienyl-ruthenium and -osmium chemistry. XL. X-ray crystal structures of MBr(PPh)-CH).CHC1(M=Ru, Os), Australian Journal of Chemistry, 48: pp 1887-1892 (1995)

Canty, A.J., Jin, H., Roberts, A.S., Traill, P.R., Skelton, B.S. and White, A.H.Synthetic and structural studies of methyl- and phenylpalladium(II) complexes of poly(pyrazol-l-yl)borates, and the h3-allylpalladium(II) complex Pd(h3-C3H5)[(pz)3BH-N,N'}, Journal of Organometallic Chemistry, 489: pp 153-159 (1995)

Canty, A.J., Fritsche, S.D., Jin, H., Skelton, B.W. and White, A.H. Oxidation reactions using water, hydrogen peroxide and halogens to give pallad(IV) cyclopentane complexes PdX(C4H8){(pz)3BH} (X = OH, Cl, Br, I). The crystal structure of the hydroxoplatinum(IV) complex Pt(OH)Me2{pz)3BH}, formed by use of water as an oxidant, Journal of Organometallic Chemistry, 490: pp C18-C19 (1995)

Canty, A.J., Hong Jin, Skelton, B.W. and White, A.H. Hydrogen-bonding 'Pd(OH)...2(HOAr)' and '[Pd(OH2)+ ... -OAr]2', and protonation of a hydroxo-ligand by pentafluorophenol in organopalladium(IV) chemistry. Structural studies of the pallada(IV) cyclopentane adducts [Pd(OH)(C4H8){pz)3BH}.2(3-MeC6H4OH)] and [Pd(OH2)(C4H8)[(pz)3BH}. (C6F5O)]2 [(pz)3BH = tris(pyrazol-l-yl)borate], Journal of Organometallic Chemistry, 503: pp C16-C18 (1995)

Canty, J.A., Jin, H., Roberts, A.S., Skelton, B.W., Traill, P.R. and White, A.H.Synthesis and characterization of ambient temperature stable organopalladium(IV) complexes, including aryl-, h1-allyl-, ethylpalladium(IV), and pallada(IV)cyclopentane complexes. Structures of the poly(pyrazol-l-yl)borate complexes PdMe3{pz)3BH} and PdMe3{pz)4B} and three polymorphs of PdMe2Et{pz)3BH}, Organometallics, 14: pp 199-206 (1995)

Cifuentes, M.P., Jeynes, T.P., Gray, M., Humphrey, M.G., Skelton, B.W. and White, A.H. Ruthenium clusters with nitrogen ligands. IV. Double C-H activation of ketimine methyl groups on triruthenium carbonyl clusters. Crystal structure of Ru3(m-H)2[m3-h2-(N,C)-4-HOC6H4N=CMeCH](CO)9.Et2O, Journal of Organometallic Chemistry, 494: pp 267-272 (1995)

Cifuentes, M.P., Humphrey, M.G., Skelton, B.W. and White, A.H. High-nuclearity ruthenium carbonyl cluster chemistry. 2, Organometallics, 14: pp 1536-1538 (1995)

David, D.M., Bakavoli, M., Pyne, S.G., Skelton, B.W. and White, A.H. The 1,3-dipolar cycloaddition reactions of C,N-diphenyl nitrone with vinyl sulfoximines, Tetrahedron, 51: pp 12393-12402 (1995)

Deacon, G.B., Feng, T., Skelton, B.W. and White, A.H. Organoamido- and aryloxo-lanthanoids. XI. Syntheses and crystal structures of Nd(Odpp)3, Nd(Odpp)3(thf) and [Nd(Odpp)3(thf)2].2(thf) (Odpp = 2,6-diphenylphenolate): variations in intramolecular p-Ph-Nd-interactions, Australian Journal of Chemistry, 48: pp 741-756 (1995)

Deacon, G.B., Fallon, G.D., Gatehouse, B.M., Rabinovich, A., Skelton, B.W. and White, A.H. Organolanthanoids. XIX. The X-ray crystal structure of di[m-(acetato-O,O:O')bis(diphenylphosphino-h5-cyclopentadienyl)ytterbium(III)] and di-(acetato-acetato-O,O:O')bis(h5-cyclopentadienyl)ytterbium(III)]-unexpected examples of formal nine coordination in lanthanoid organometallics, Journal of Organometallic Chemistry, 501: pp 23-30 (1995)

Du Boulay, D., Maslen, E.N., Streltsov, V.A. and Ishizawa, N. A synchrotron X-ray study of the electron density in a YFe03, Acta Crystallographica, B51: pp 921-929 (1995)

Hall, S.R. and Cook, A.P.F. STAR Dictionary Language: Initial Specification, Journal of Chemical Information and Computer Science, 35: pp 819-825 (1995)

Hester, J.R. and Maslen, E.N. Electron Density - Structure Relationships in Some Perovskite-Type Compounds, Acta Crystallographica, B51: pp 913-920 (1995)

Humphrey, M.G., Hockless, D.C.R., Skelton, B.W., White, A.H. and Whittall, I.R.Organometallic complexes for nonlinear optics. 2. Syntheses, electrochemical studies, structural characterization, and computationally-derived molecular quadratic hyperpolarizabilities of ruthenium s-arylacetylides: X-ray crystal structures of Ru(CºCPh)(PMe3)2(h-C5H5) and Ru(CºCC6H4NO2-4)(L)2(h-C5H5)(L=PPh3,PMe3), Organometallics, 14: pp 3970-3979 (1995)

James, B.D., Liesegang, J., Bakalova, M., Reiff, W.M., Skelton, B.W. and White, A.H.The unsolvated pentachloroferrate(III)ion. X-ray crystal structure and low-temperature magnetism of tetramethylpiperazinium pentachloroferrate(III), Inorganic Chemistry, 34: pp 2054-2057 (1995)

Jin, H., Cavell, K.J., Skelton, B.W. and White, A.H. Synthesis and carbonylation studies on methylpalladium(II) complexes containing chelating pyridinecarboxylate ligands: dynamic behaviour of the ligands and implications for the carbonylation mechanism, Journal of the Chemical Society Dalton Transactions, 1995: pp 2159-2169 (1995)

Maslen, E.N., Streltsov, V.A., Streltsova, N.R. and Ishizawa, N. Electron density and optical anisotropy in rhombohedral carbonates. III. Synchrotron X-ray studies of CaCO3, MgCO3 and MnCO3., Acta Crystallographica, B51: pp 929-939 (1995)

Maslen, E.N., Spadaccini, N., Ito, T., Marumo, F. and Satow, Y. A synchrotron radiation study of strontium titanate, Acta Crystallographica, B51: pp 939-941 (1995)

Pyne, S.G., Dong, Z., Skelton, B.W. and White, A.H. Diastereoselective reductions of b-substituted g-keto sulfoximines and a novel palladium(0)-catalysed allylic sulfoximine to allylic sulfinamide rearrangement, Journal of the Chemical Society Chemical Communications, pp 445-446 (1995)

Pyne, S.G., Safaei-G, J., Skelton, B.W. and White, A.H. 1,3-Dipolar cycloadditions of a chiral oxazolidinone with nitrones and nitrile oxides, Australian Journal of Chemistry, 48: pp 1511-1533 (1995)

Pyne, S.G., Javidan, A., Skelton, B.W. and White, A.H. Asymmetric synthesis of proline derivatives from (2R) and (2S)-2-tert-butyl-3-zenzoyl-4-methyleneoxazolidin-5-one., Tetrahedron, 51: pp 5157-5168 (1995)

Conference Publications

Du Boulay, D. and Maslen, E.N. Crystal Chemistry and Electron Density in Metal Oxides, Crystal XIX Meeting of the Society of Crystallogrpahers in Australia, Ballarat, Society of Crystallographers in Australia, pp WPM2.3-WPM2.3 (1995)

Etschmann, B.E. and Maslen, E.N. Atomic Radii from Electron Densities, CRYSTAL XIX Meeting of the SOciety of Crystallogrpher in Australia, Ballarat, Society of Crystallographers in Australia, pp 5-5 (1995)

Etschmann, B.E. and Maslen, E.N. Atomic Radii from Electron Densities, AsCA'95 2nd conference of the Asian Crystallographic Association, Bangkok, Asian Crystallographic Association, pp 3P46-3P46 (1995)

Hall, S.R. and Spadaccini, N. Software manipulation and validation of Star files, American Crystallographic Association Conference, Montreal, American Crystallographic Association, 23: pp 31-31 (1995)

Hall, S.R. CIF Developments, Current and Future, European Crystallographers Meeting 16, Lund, Sweden, European Crystallographic Association, ECM16: pp 9-9 (1995)

Hall, S.R., Du Boulay, D., Hester, J.R. and Grossie, D. XTAL_GX: CIF-entry graphics for geometry analysis, AsCA'95 2nd Conference of the Asian Crystallographic Association, Bangkok, Asian Crystallographic Association, pp 1B13-1B13 (1995)

Hall, S.R. General approach to CIF processing based on CIFIO, American Crystallographic Association Conference, 1995, American Crystallographic Association, 23: pp 30-30 (1995)

Hester, J.R. and Hall, S.R. BUNYIP: a new approach to detecting errant symmetry, AsCA'95 2nd Conference of the Asian Crystallographic Association, Bangkok, Asian Crystallographic Association, pp 1P50-1P50 (1995)

Hsu, R. and Maslen, E.N. Effect of Second-Nearest Neighbour Interactions on the Electron Density in Y2BaCuO5&LiTaO3, Crystal XIX Meeting of the Society of Crystallographers in Australia, Ballarat, Society of Crystallographers in Australia, p 15 (1995)

Maslen, E.N. and Streltsov, V.A. Synchrotron X-ray study of the Electron Density in C-type rare earth oxides., CRYSTAL XIX Meeting of the Society of Crystallographers in Australia, Ballarat, Victoria, Society of Crystallographers in Australia, p P29 (1995)

Maslen, E.N. and Streltsov, V.A. Electron density imaging with synchrotron radiation, AsCA'95 2nd Conference of the Asian Crystallographic Association, Bangkok, Asian Crystallographic Association, pp 1A14-1A14 (1995)

Othman, A.H., Effendi and White, A.H. Crystal structure of binuclear 1:1 silver(I) 2-hydroxy-3,5-dinitrobenzoate:triphenylphosphine complex, AsCA'95 2nd Conference of the Asian Crystallographic Association, Bangkok, Thailand, Chulalongkorn University, pp 2P24-2P24 (1995)

Streltsov, V.A. Crystal Chemistry and Electron Density in Metal Oxides, CRYSTAL XIX Meeting of the Society of Crystallographers in Australia, Ballarat, Society of Crystallographers in Australia, pp WPM2.2-WPM2.2 (1995)

Others

Hall, S.R. XTAL3.4: Crystallographic Software for UNIX and VMS, 3.4, UWA (1995)