Synthesis, characterization, dynamics and reactivity toward amination of η3-allyl palladium complexes bearing mixed ancillary ligands. Evaluation of the electronic characteristics of the ligands from kinetic data.
Canovese, Luciano; Visentin, Fabiano; Levi, Carlo; Dolmella, Alessandro; Dalton transactions (Cambridge, England : 2003) 40 (2011) 966–981; doi:10.1039/c0dt00811g

data_7014425
_publ_section_title
;
 Synthesis, characterization, dynamics and reactivity toward amination
 of \h3-allyl palladium complexes bearing mixed ancillary ligands.
 Evaluation of the electronic characteristics of the ligands from
 kinetic data.
;
_journal_issue                   4
_journal_name_full
'Dalton transactions (Cambridge, England : 2003)'
_journal_page_first              966
_journal_page_last               981
_journal_paper_doi               10.1039/c0dt00811g
_journal_volume                  40
_journal_year                    2011
_chemical_formula_sum            'C44 H48 Cl N2 O4 P Pd'
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;
?
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CrysAlisPro, Oxford Diffraction Ltd.,
Version 1.171.33.52 (release 06-11-2009 CrysAlis171 .NET)
(compiled Nov 6 2009,16:24:50)
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CrysAlisPro, Oxford Diffraction Ltd.,
Version 1.171.33.52 (release 06-11-2009 CrysAlis171 .NET)
(compiled Nov 6 2009,16:24:50)
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CrysAlisPro, Oxford Diffraction Ltd.,
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(compiled Nov 6 2009,16:24:50)
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1 omega -2.00 45.00 1.0000 37.8300
omega____ theta____ kappa____ phi______ frames
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2 omega -33.00 -3.00 1.0000 37.8300
omega____ theta____ kappa____ phi______ frames
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3 omega 18.00 53.00 1.0000 37.8300
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4 omega -33.00 -1.00 1.0000 37.8300
omega____ theta____ kappa____ phi______ frames
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5 omega 34.00 59.00 1.0000 37.8300
omega____ theta____ kappa____ phi______ frames
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6 omega -55.00 -23.00 1.0000 37.8300
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7 omega -10.00 90.00 1.0000 37.8300
omega____ theta____ kappa____ phi______ frames
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8 omega -11.00 90.00 1.0000 37.8300
omega____ theta____ kappa____ phi______ frames
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9 omega -55.00 51.00 1.0000 37.8300
omega____ theta____ kappa____ phi______ frames
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10 omega -55.00 6.00 1.0000 37.8300
omega____ theta____ kappa____ phi______ frames
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11 omega 26.00 51.00 1.0000 37.8300
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12 omega -52.00 43.00 1.0000 37.8300
omega____ theta____ kappa____ phi______ frames
- 17.4679 -38.0000 -150.0000 95

13 omega -16.00 89.00 1.0000 37.8300
omega____ theta____ kappa____ phi______ frames
- 17.4679 77.0000 0.0000 105

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_diffrn_radiation_wavelength     0.71073
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_diffrn_standards_decay_%        negligible
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_exptl_absorpt_coefficient_mu    0.617
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CrysAlisPro, Oxford Diffraction Ltd.,
Version 1.171.33.52 (release 06-11-2009 CrysAlis171 .NET)
(compiled Nov 6 2009,16:24:50)
Empirical absorption correction using spherical harmonics,
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_exptl_crystal_colour            colourless
_exptl_crystal_density_diffrn    1.401
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       parallelipepds
_exptl_crystal_F_000             1744
_exptl_crystal_size_max          0.40
_exptl_crystal_size_mid          0.08
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_refine_ls_matrix_type           full
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_refine_ls_restrained_S_all      0.802
_refine_ls_R_factor_all          0.0744
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_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
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'calc w=1/[\s^2^(Fo^2^)+(0.0244P)^2^+0.0000P] where P=(Fo^2^+2Fc^2^)/3'
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_reflns_threshold_expression     >2sigma(I)
_cod_data_source_file            C0DT00811G.TXT
_cod_data_source_block           exp_63
_cod_original_cell_volume        3989.4(1)
_cod_original_sg_symbol_H-M      'P 1 21/n 1 (No.14)'
_cod_database_code               7014425