Oximate-substituted zirconium alkoxides.
Baumann, Stefan O.; Puchberger, Michael; Schubert, Ulrich; Dalton transactions (Cambridge, England : 2003) 40 (2011) 1401–1406; doi:10.1039/c0dt00384k

data_7014325
_publ_section_title
;
 Oximate-substituted zirconium alkoxides.
;
_journal_issue                   6
_journal_name_full
'Dalton transactions (Cambridge, England : 2003)'
_journal_page_first              1401
_journal_page_last               1406
_journal_paper_doi               10.1039/c0dt00384k
_journal_volume                  40
_journal_year                    2011
_chemical_formula_moiety         'C42 H74 N6 O8 Zr2'
_chemical_formula_sum            'C42 H74 N6 O8 Zr2'
_chemical_formula_weight         973.51
_chemical_name_systematic
;
?
;
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_symmetry_cell_setting           triclinic
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_atom_sites_solution_primary     direct
_atom_sites_solution_secondary   difmap
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_cell_angle_beta                 112.554(4)
_cell_angle_gamma                91.132(4)
_cell_formula_units_Z            1
_cell_length_a                   10.506(3)
_cell_length_b                   10.728(3)
_cell_length_c                   10.954(3)
_cell_measurement_reflns_used    1941
_cell_measurement_temperature    293(2)
_cell_measurement_theta_max      23.404
_cell_measurement_theta_min      2.295
_cell_volume                     1113.5(5)
_computing_cell_refinement       'Bruker-AXS APEX 2 Software'
_computing_data_collection       'Bruker-AXS APEX 2 Software'
_computing_data_reduction        'Bruker-AXS APEX 2 Software'
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_computing_publication_material  'Bruker-AXS SHELXTL Software'
_computing_structure_refinement  'SHELXL-97 (Sheldrick, 1997)'
_computing_structure_solution    'SHELXS-97 (Sheldrick, 1990)'
_diffrn_ambient_temperature      293(2)
_diffrn_measured_fraction_theta_full 0.991
_diffrn_measured_fraction_theta_max 0.991
_diffrn_measurement_device       'Bruker-AXS KAPPA APEX II CCD Detector'
_diffrn_measurement_method       omega-scans
_diffrn_radiation_monochromator  graphite
_diffrn_radiation_source         'fine-focus sealed tube'
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_diffrn_reflns_limit_l_min       -14
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_diffrn_reflns_theta_max         28.33
_diffrn_reflns_theta_min         2.86
_diffrn_standards_interval_time  15
_exptl_absorpt_coefficient_mu    0.525
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_exptl_absorpt_correction_T_min  0.8888
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   SADABS
_exptl_crystal_colour            colorless
_exptl_crystal_density_diffrn    1.452
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       prism
_exptl_crystal_F_000             512
_exptl_crystal_size_max          0.23
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_refine_ls_extinction_method     none
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_refine_ls_R_factor_all          0.0885
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_refine_ls_shift/su_max          0.001
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'calc w=1/[\s^2^(Fo^2^)+(0.0605P)^2^+0.0000P] where P=(Fo^2^+2Fc^2^)/3'
_refine_ls_weighting_scheme      calc
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