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    1. Smith, EDL; Hammond, RB; Jones, MJ; Roberts, KJ; Mitchell, JBO; Price, SL; Harris, RK; Apperley, DC; Cherryman, JC; Docherty, R
      The determination of the crystal structure of anhydrous theophylline by X-ray powder diffraction with a systematic search algorithm, lattice energy calculations, and C-13 and N-15 solid-state NMR: A question of polymorphism in a given unit cell

      JOURNAL OF PHYSICAL CHEMISTRY B
    2. Nielsen, UG; Jakobsen, HJ; Skibsted, J
      V-51 MAS NMR investigation of V-51 quadrupole coupling and chemical shift anisotropy in divalent metal pyrovanadates

      JOURNAL OF PHYSICAL CHEMISTRY B
    3. Nielsen, UG; Jakobsen, HJ; Skibsted, J; Norby, P
      Crystal structure of alpha-Mg2V2O7 from synchrotron X-ray powder diffraction and characterization by V-51 MAS NMR spectroscopy

      JOURNAL OF THE CHEMICAL SOCIETY-DALTON TRANSACTIONS
    4. Muller, T
      A silyl cation with a three-center Si-H-Si bond

      ANGEWANDTE CHEMIE-INTERNATIONAL EDITION
    5. Wu, G; Dong, S; Ida, R
      Solid-state O-17 NMR of thymine: a potential new probe to nucleic acid base pairing

      CHEMICAL COMMUNICATIONS
    6. Gilchrist, ML; Monde, K; Tomita, Y; Iwashita, T; Nakanishi, K; McDermott, AE
      Measurement of interfluorine distances in solids

      JOURNAL OF MAGNETIC RESONANCE
    7. Bechmann, M; Helluy, X; Sebald, A
      Double-quantum-filtered rotational-resonance MAS NMR in the presence of large chemical shielding anisotropies

      JOURNAL OF MAGNETIC RESONANCE
    8. Odgaard, L; Bak, M; Jakobsen, HJ; Nielsen, NC
      C-13 chemical shift and C-13-N-14 dipolar coupling. tensors determined by C-13 rotary resonance solid-state NMR

      JOURNAL OF MAGNETIC RESONANCE
    9. Jimenez-Vazquez, HA; Tamariz, J; Cross, RJ
      Binding energy in and equilibrium constant of formation for the dodecahedrane compounds He@C20H20 and Ne@C20H20

      JOURNAL OF PHYSICAL CHEMISTRY A
    10. Heine, T; Goursot, A; Seifert, G; Webert, J
      Performance of DFT for Si-29 NMR chemical shifts of silanes

      JOURNAL OF PHYSICAL CHEMISTRY A
    11. Herges, R; Geuenich, D
      Delocalization of electrons in molecules

      JOURNAL OF PHYSICAL CHEMISTRY A
    12. Sanders, LK; Arnold, WD; Oldfield, E
      NMR, IR, Mossbauer and quantum chemical investigations of metalloporphyrins and metalloproteins

      JOURNAL OF PORPHYRINS AND PHTHALOCYANINES
    13. Nakanishi, W; Hayashi, S
      On the equilibrium between molecular complexes and trigonal bipyramidal adducts of diaryl sesenide dibromides in solution

      HETEROATOM CHEMISTRY
    14. Perczel, A; Csaszar, AG
      Toward direct determination of conformations of protein building units from multidimensional NMR experiments part II: A theoretical case study of Formyl-L-Valine amide

      CHEMISTRY-A EUROPEAN JOURNAL
    15. Buhl, M; Parrinello, M
      Medium effects on V-51 NMR chemical shifts: A density functional study

      CHEMISTRY-A EUROPEAN JOURNAL
    16. Nielsen, UG; Jakobsen, HJ; Skibsted, J
      Co-59 chemical shift anisotropy and quadrupole coupling for K3Co(CN)(6) from MQMAS and MAS NMR spectroscopy

      SOLID STATE NUCLEAR MAGNETIC RESONANCE
    17. Gee, B
      Homonuclear vanadium-51 dipolar couplings in inorganic solids obtained viaHahn spin echo decay NMR spectroscopy

      SOLID STATE NUCLEAR MAGNETIC RESONANCE
    18. Bryce, DL; Wasylishen, RE
      Modeling (2h)J(iso)(N,N) in nucleic acid base pairs: Ab initio characterization of the (2h)J(N, N) tensor in the methyleneimine dimer as a function of hydrogen bond geometry

      JOURNAL OF BIOMOLECULAR NMR
    19. Pellei, M; Pettinari, C
      On the interaction between imidazoles and cadmium salts. Comparison between cadmium and zinc complexes of imidazoles

      MAIN GROUP METAL CHEMISTRY
    20. Grossmann, G; Ohms, G; Kruger, K; Karaghiosoff, K; Eckstein, K; Hahn, J; Hopp, A; Malkina, OL; Hrobarik, P
      Diselenadiphosphetane diselenides and triselenadiphospholane diselenides -Synthesis and characterization by P-31 and Se-77 solid-state MNR spectroscopy

      ZEITSCHRIFT FUR ANORGANISCHE UND ALLGEMEINE CHEMIE
    21. Casanovas, J; Namba, AM; Leon, S; Aquino, LB; da Silva, GVJ; Aleman, C
      Calculated and experimental NMR chemical shifts of p-menthane-3,9-diols. Acombination of molecular dynamics and quantum mechanics to determine the structure and the solvent effects

      JOURNAL OF ORGANIC CHEMISTRY
    22. Patchkovskii, S; Autschbach, J; Ziegler, T
      Curing difficult cases in magnetic properties prediction with self-interaction corrected density functional theory

      JOURNAL OF CHEMICAL PHYSICS
    23. Reger, DL; Wright, TD; Semeniuc, RF; Grattan, TC; Smith, MD
      Supramolecular structures of cadmium(II) coordination polymers: A new class of ligands formed by linking tripodal tris(pyrazolyl)methane units

      INORGANIC CHEMISTRY
    24. Gomes, JANF; Mallion, RB
      Aromaticity and ring currents

      CHEMICAL REVIEWS
    25. Ding, SW; McDowell, CA
      High resolution Na-23 and Al-27 NMR satellite transition spectroscopy (SATRAS) of natural sodalite (Na8Cl2(AlSiO4)(6)) under magic-angle-spinning

      CHEMICAL PHYSICS LETTERS
    26. Brender, JR; Taylor, DM; Ramamoorthy, A
      Orientation of amide-nitrogen-15 chemical shift tensors in peptides: A quantum chemical study

      JOURNAL OF THE AMERICAN CHEMICAL SOCIETY
    27. Harper, JK; Mulgrew, AE; Li, JY; Barich, DH; Strobel, GA; Grant, DM
      Characterization of stereochemistry and molecular conformation using solid-state NMR tensors

      JOURNAL OF THE AMERICAN CHEMICAL SOCIETY
    28. Wu, G; Dong, S
      Two-dimensional O-17 multiple quantum magic-angle spinning NMR of organic solids

      JOURNAL OF THE AMERICAN CHEMICAL SOCIETY
    29. Kaupp, M; Rovira, C; Parrinello, M
      Density functional study of O-17 NMR chemical shift and nuclear quadrupolecoupling tensors in oxyheme model complexes

      JOURNAL OF PHYSICAL CHEMISTRY B
    30. Moore, EA; Johnson, C; Mortimer, M; Wigglesworth, C
      A comparison of ab initio cluster and periodic calculations of the electric field gradient at sodium in NaNO2

      PHYSICAL CHEMISTRY CHEMICAL PHYSICS
    31. Gauss, J; Werner, HJ
      NMR chemical shift calculations within local correlation methods: the GIAO-LMP2 approach

      PHYSICAL CHEMISTRY CHEMICAL PHYSICS
    32. van Wullen, C
      A comparison of density functional methods for the calculation of phosphorus-31 NMR chemical shifts

      PHYSICAL CHEMISTRY CHEMICAL PHYSICS
    33. Juselius, J; Sundholm, D
      The aromatic pathways of porphins, chlorins and bacteriochlorins

      PHYSICAL CHEMISTRY CHEMICAL PHYSICS
    34. Pyykko, P
      Perspective on Norman Ramsey's theories of NMR chemical shifts and nuclearspin-spin coupling - Phys Rev 77 : 567 (1950) to Phys Rev 91 : 303 (1953)

      THEORETICAL CHEMISTRY ACCOUNTS
    35. Lapina, OB; Khabibulin, DF; Shubin, AA; Bondareva, VM
      V-51 and P-31 NMR studies of VOx/TiO2 catalysts modified by phosphorous

      JOURNAL OF MOLECULAR CATALYSIS A-CHEMICAL
    36. Dong, S; Ida, R; Wu, G
      A combined experimental and theoretical O-17 NMR study of crystalline urea: An example of large hydrogen-bonding effects

      JOURNAL OF PHYSICAL CHEMISTRY A
    37. Bernard, GM; Wasylishen, RE; Phillips, AD
      A carbon-13 and deuterium NMR investigation of solid platinum-ethylene complexes: Zeise's salt and Pt(eta(2)-C2H4)(PPh3)(2)

      JOURNAL OF PHYSICAL CHEMISTRY A
    38. Bryce, DL; Wasylishen, RE
      Dipolar-chemical shift and rotational resonance C-13 NMR studies of the carboxyl-methylene carbon spin pair in solid phenylacetic acid and potassium hydrogen bisphenylacetate

      JOURNAL OF PHYSICAL CHEMISTRY A
    39. Robert, V; Petit, S; Borshch, SA; Bigot, B
      Theoretical analysis of P-31 NMR chemical shifts in vanadium phosphorus oxides

      JOURNAL OF PHYSICAL CHEMISTRY A
    40. Gee, M; Wasylishen, RE; Eichele, K; Britten, JF
      Phosphorus chemical shift tensors for tetramethyldiphosphine disulfide: A P-31 single-crystal NMR, dipolar-chemical shift NMR, and ab initio molecular orbital study

      JOURNAL OF PHYSICAL CHEMISTRY A
    41. Schurko, RW; Wasylishen, RE
      Nitrogen-15 NMR study of solid cobaloximes containing N-15-labeled pyridine and aniline

      JOURNAL OF PHYSICAL CHEMISTRY A
    42. Orendt, AM; Facelli, JC; Bai, S; Rai, A; Gossett, M; Scott, LT; Boerio-Goates, J; Pugmire, RJ; Grant, DM
      Carbon-13 shift tensors in polycyclic aromatic compounds. 8. A low-temperature NMR study of coronene and corannulene

      JOURNAL OF PHYSICAL CHEMISTRY A
    43. Reger, DL; Wright, TD; Smith, MD; Rheingold, AL; Rhagitan, B
      X-ray crystal structures of [HB(3,4,5-Me(3)pz)(3)](2)Zn, [H2B(3,4,5-Me(3)pz)(2)]Zn(mu-3,4,5-Me(3)pz)(2)Zn[H2B(3,4,5-Me(3)pz)(2)], and [H2B(pz)(2)](2)Zn (pz = pyrazolyl ring)

      JOURNAL OF CHEMICAL CRYSTALLOGRAPHY
    44. Lantto, P; Kaski, J; Vaara, J; Jokisaari, J
      Spin - spin coupling tensors in fluoromethanes

      CHEMISTRY-A EUROPEAN JOURNAL
    45. Roversi, E; Monnat, F; Schenk, K; Vogel, P; Brana, P; Sordo, JA
      O-17 NMR spectroscopy of sulfolenes (2,5-dihydrothiophene-1,1-dioxides) and sultines (3,6-dihydro-1,2-oxathiin-2-oxides)-experiment and quantum calculations: Synthesis of 4,9-dioxo-1,2-oxathiacyclodecane-2-oxide, a new heterocycle

      CHEMISTRY-A EUROPEAN JOURNAL
    46. Xue, XY; Kanzaki, M
      An ab initio calculation of O-17 and Si-29 NMR parameters for SiO2 polymorphs

      SOLID STATE NUCLEAR MAGNETIC RESONANCE
    47. Nomura, K; Takegoshi, K; Terao, T; Uchida, K; Kainosho, M
      Three-dimensional structure determination of a uniformly labeled molecule by frequency-selective dipolar recoupling under magic-angle spinning

      JOURNAL OF BIOMOLECULAR NMR
    48. Shubin, AA; Lapina, OB; Courcot, D
      Characterization by solid state V-51 NMR spectroscopy

      CATALYSIS TODAY
    49. Kupka, T; Pasterna, G; Jaworska, M; Karali, A; Dais, P
      GIAO NMR calculations for carbazole and its N-methyl and N-ethyl derivatives. Comparison of theoretical and experimental C-13 chemical shifts

      MAGNETIC RESONANCE IN CHEMISTRY
    50. Jelinski, LW; Melchior, MT
      High-resolution NMR of solids (Reprinted from NMR Spectroscopy Techniques,Second Edition, Revised and Expanded, pg 417-485, 1996)

      APPLIED SPECTROSCOPY REVIEWS
    51. Ganicz, K
      Solid state NMR spectroscopy as a tool to investigation of structure and dynamics of amino acids and model peptides

      BULLETIN OF THE POLISH ACADEMY OF SCIENCES-CHEMISTRY
    52. Jackowski, K; Molchanov, S; Gryff-Keller, A
      Effect of planar substituents on magnetic shielding tensors of sp-hybridized carbon nuclei in substituted acetylenes - a GIAO-CHF study

      BULLETIN OF THE POLISH ACADEMY OF SCIENCES-CHEMISTRY
    53. Perczel, A; Csaszar, AG
      Toward direct determination of conformations of protein building units from multidimensional NMR experiments I. A theoretical case study of For-Gly-NH2 and For-L-Ala-NH2

      JOURNAL OF COMPUTATIONAL CHEMISTRY
    54. Lazzeretti, P
      Ring currents

      PROGRESS IN NUCLEAR MAGNETIC RESONANCE SPECTROSCOPY
    55. Gabuda, SP; Kozlova, SG; Paasonen, VM; Nazarov, AS
      Chemical bonding and molecular dynamics in inclusion compounds of fluorinated graphite according to F-19 NMR spectroscopy data

      JOURNAL OF STRUCTURAL CHEMISTRY
    56. Schleyer, PV; Najafian, K; Kiran, B; Jiao, HJ
      Are oxocarbon dianions aromatic?

      JOURNAL OF ORGANIC CHEMISTRY
    57. Juselius, J; Sundholm, D
      The aromatic character of magnesium porphyrins

      JOURNAL OF ORGANIC CHEMISTRY
    58. Wasylishen, RE; Bryce, DL; Evans, CJ; Gerry, MCL
      Hyperfine structure in the rotational spectrum of GaF: A comparison of experimental and calculated spin-rotation and electric field gradient tensors

      JOURNAL OF MOLECULAR SPECTROSCOPY
    59. Dahn, H
      Understanding chemical shifts in pi systems: C-13, N-15, O-17 NMR

      JOURNAL OF CHEMICAL EDUCATION
    60. Schreckenbach, G
      Mixed uranium chloride fluorides UF6-nCln and methoxyuranium fluorides UF6-n(OCH3)(n): A theoretical study of equilibrium geometries, vibrational frequencies, and the role of the f orbitals

      INORGANIC CHEMISTRY
    61. Nielsen, UG; Jakobsen, HJ; Skibsted, J
      Characterization of divalent metal metavanadates by V-51 magic-angle spinning NMR spectroscopy of the central and satellite transitions

      INORGANIC CHEMISTRY
    62. Czernek, J; Sklenar, V
      Ab initio calculations of NMR chemical shifts in biomolecular systems

      CHEMICKE LISTY
    63. Bernard, GM; Eichele, K; Wu, G; Kirby, CW; Wasylishen, RE
      Nuclear magnetic shielding tensors for the carbon, nitrogen, and selenium nuclei of selenocyanates - a combined experimental and theoretical approach

      CANADIAN JOURNAL OF CHEMISTRY-REVUE CANADIENNE DE CHIMIE
    64. Gee, M; Wasylishen, RE; Eichele, K; Wu, G; Cameron, TS; Mathey, F; Laporte, F
      Characterization of phosphorus chemical shielding tensors in a phosphole tetramer: a combined experimental and theoretical study

      CANADIAN JOURNAL OF CHEMISTRY-REVUE CANADIENNE DE CHIMIE
    65. Bryce, DL; Wasylishen, RE
      Symmetry properties of indirect nuclear spin-spin coupling tensors: First principles results for ClF3 and OF2

      JOURNAL OF THE AMERICAN CHEMICAL SOCIETY
    66. Larsen, FH; Skibsted, J; Jakobsen, HJ; Nielsen, NC
      Solid-state QCPMG NMR of low-gamma quadrupolar metal nuclei in natural abundance

      JOURNAL OF THE AMERICAN CHEMICAL SOCIETY
    67. Bull, LM; Bussemer, B; Anupold, T; Reinhold, A; Samoson, A; Sauer, J; Cheetham, AK; Dupree, R
      A high-resolution O-17 and Si-29 NMR study of zeolite siliceous ferrieriteand ab initio calculations of NMR parameters

      JOURNAL OF THE AMERICAN CHEMICAL SOCIETY
    68. Arnold, WD; Sanders, LK; McMahon, MT; Volkov, RV; Wu, G; Coppens, P; Wilson, SR; Godbout, N; Oldfield, E
      Experimental, Hartree-Fock, and density functional theory investigations of the charge density, dipole moment, electrostatic potential, and electric field gradients in L-asparagine monohydrate

      JOURNAL OF THE AMERICAN CHEMICAL SOCIETY
    69. Hong, M
      Solid-state NMR determination of C-13 alpha chemical shift anisotropies for the identification of protein secondary structure

      JOURNAL OF THE AMERICAN CHEMICAL SOCIETY
    70. Bryce, DL; Wasylishen, RE
      Indirect nuclear spin-spin coupling tensors in diatomic molecules: A comparison of results obtained by experiment and first principles calculations

      JOURNAL OF THE AMERICAN CHEMICAL SOCIETY
    71. Shubin, AA; Lapina, OB; Bosch, E; Spengler, J; Knozinger, H
      Effect of milling of V2O5 on the local environment of vanadium as studied by solid-state V-51 NMR and complementary methods

      JOURNAL OF PHYSICAL CHEMISTRY B
    72. Donkervoort, JG; Buhl, M; Ernsting, JM; Elsevier, CJ
      Steric and electronic effects on the Rh-103 NMR chemical shifts of Rh-I(cyclooctadiene) compounds bearing N-donor ligands

      EUROPEAN JOURNAL OF INORGANIC CHEMISTRY
    73. Dusold, S; Maisel, H; Sebald, A
      Magnitudes and orientations of interaction tensors determined from rotational resonance MAS NMR lineshapes of a four-C-13-spin system

      JOURNAL OF MAGNETIC RESONANCE
    74. Alder, RW; Blake, ME; Oliva, JM
      Diaminocarbenes; Calculation of barriers to rotation about C-carbene-N bonds, barriers to dimerization, proton affinities, and C-13 NMR shifts

      JOURNAL OF PHYSICAL CHEMISTRY A
    75. Kaski, J; Lantto, P; Rantala, TT; Schroderus, J; Vaara, J; Jokisaari, J
      Experimental and theoretical study of the spin-spin coupling tensors in methylsilane

      JOURNAL OF PHYSICAL CHEMISTRY A
    76. Skibsted, J; Jakobsen, HJ
      Variable-temperature Rb-87 magic-angle spinning NMR spectroscopy of inorganic rubidium sails

      JOURNAL OF PHYSICAL CHEMISTRY A
    77. Harwell, CR; Mrse, AA; Shelby, AI; Butler, LG; Hall, RW
      Ab initio calculation of Br-18 nuclear quadrupole resonance transition frequencies for brominated aromatics (flame retardants)

      JOURNAL OF PHYSICAL CHEMISTRY A
    78. Baldridge, KK; Siegel, JS
      Correlation of empirical delta(TMS) and absolute NMR chemical shifts predicted by ab initio computations

      JOURNAL OF PHYSICAL CHEMISTRY A
    79. Czernek, J; Sklenar, V
      Ab initio calculations of H-1 and C-13 chemical shifts in anhydrodeoxythymidines

      JOURNAL OF PHYSICAL CHEMISTRY A
    80. Fleischer, U
      Calculations of phosphorus nuclear magnetic shielding tensors - Studies onphosphorus chalcogen compounds

      PHOSPHORUS SULFUR AND SILICON AND THE RELATED ELEMENTS
    81. Bagno, A; Bujnicki, B; Bertrand, S; Comuzzi, C; Dorigo, F; Janvier, P; Scorrano, G
      Site of protonation of carboxylic and non-carboxylic amides in the gas phase and in water

      CHEMISTRY-A EUROPEAN JOURNAL
    82. Buhl, M
      Density functional calculations of Mo-95 NMR chemical shifts: Applicationsto model catalysts for imine metathesis

      CHEMISTRY-A EUROPEAN JOURNAL
    83. Iwadate, M; Asakura, T; Williamson, MP
      C-alpha and C-beta carbon-13 chemical shifts in proteins from an empiricaldatabase

      JOURNAL OF BIOMOLECULAR NMR
    84. Dokalik, A; Kalchhauser, H; Mikenda, W; Schweng, G
      NMR spectra of nitrogen-containing compounds. Correlations between experimental and GIAO calculated data

      MAGNETIC RESONANCE IN CHEMISTRY
    85. Lazzeretti, P; Caputo, MC; Ferraro, MB
      Thomas-Reiche-Kuhn populations in alkanes

      CHEMICAL PHYSICS
    86. Martinez-Merino, V; Gil, MJ
      Theoretical density functional and ab initio computational study of vertical ionization potentials, dipole moments and C-13 and N-14-NMR shifts of the 2-mercaptopyridine system. A model for thiated nucleobases

      JOURNAL OF THE CHEMICAL SOCIETY-PERKIN TRANSACTIONS 2
    87. Marchetti, F; Pettinari, C; Pettinari, R; Cingolani, A; Leonesi, D; Lorenzotti, A
      Group 12 metal complexes of tetradentate N2O2-Schiff-base ligands incorporating pyrazole - Synthesis, characterisation and reactivity toward S-donors, N-donors, copper and tin acceptors

      POLYHEDRON
    88. Leitner, W; Buhl, M; Fornika, R; Six, C; Baumann, W; Dinjus, E; Kessler, M; Kruger, C; Rufinska, A
      Rh-103 chemical shifts in complexes bearing chelating bidentate phosphine ligands

      ORGANOMETALLICS
    89. Reger, DL
      Tris(pyrazolyl)methane ligands: The neutral analogs of tris(pyrazolyl)borate ligands

      COMMENTS ON INORGANIC CHEMISTRY
    90. Ejchart, A; Jackowski, K; Gryff-Keller, A
      Magnetic shielding tensors of sp-hybridized carbons in butadiynyltrimethylsilane. C-13 nuclear spin relaxation and ab initio study

      BULLETIN OF THE POLISH ACADEMY OF SCIENCES-CHEMISTRY
    91. Buhl, M
      Theoretical study of a vanadate peptide complex

      JOURNAL OF COMPUTATIONAL CHEMISTRY
    92. Wemmer, D
      Solid-state nuclear magnetic resonance of protein deposits

      AMYLOID, PRIONS, AND OTHER PROTEIN AGGREGATES
    93. Gregor, T; Mauri, F; Car, R
      A comparison of methods for the calculation of NMR chemical shifts

      JOURNAL OF CHEMICAL PHYSICS
    94. Ferraro, MB; Caputo, MC
      Ab initio calculation of atomic contributions to the magnetic susceptibility by continuous transformation of the origin of the current density in HF,H2O, NH3, and CH4 molecules

      JOURNAL OF CHEMICAL PHYSICS
    95. Cromp, B; Carrington, T; Salahub, DR; Malkina, OL; Malkin, VG
      Effect of rotation and vibration on nuclear magnetic resonance chemical shifts: Density functional theory calculations

      JOURNAL OF CHEMICAL PHYSICS
    96. Bebout, DC; Stokes, SW; Butcher, RJ
      Comparison of heteronuclear coupling constants for isostructural nitrogen coordination compounds of Cd-111/113 and Hg-199

      INORGANIC CHEMISTRY
    97. Reger, DL; Collins, JE; Rheingold, AL; Liable-Sands, LM
      Solid state structure of {[HC(3,5-Me(2)pz)(3)][HB(3,5-Me(2)pz)(3)]Cd}-{B[3,5-(CF3)(2)C6H3](4): Comparison of the bonding of tris(pyrazolyl)methane and tris(pyrazolyl)borate ligands

      INORGANIC CHEMISTRY
    98. Fyfe, CA; Altenschildesche, HMZ; Skibsted, J
      Characterization of Na5P3O10 polymorphs by Na-23 MAS, Na-23 MQMAS, and P-31 MAS NMR spectroscopy

      INORGANIC CHEMISTRY
    99. Zanasi, R
      Resolution of molecular electric hyperpolarizabilities into atomic terms

      CHEMICAL PHYSICS LETTERS
    100. Orendt, AM; Facelli, JC; Grant, DM
      A theoretical study of the acetate C-13 chemical shift tensor in cadmium acetate dihydrate

      CHEMICAL PHYSICS LETTERS


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Documento generato il 27/05/20 alle ore 12:52:56