OH Functionality of Germanium(II) Compounds for the Formation of Heterobimetallic Oxides
Leslie W. Pineda; Vojtech Jancik; Herbert W. Roesky; Regine Herbst-Irmer; Inorganic Chemistry 44 (2005) 3537–3540; doi:10.1021/ic048383f

data_1100712
_publ_contact_author_address
;

Institut f\"ur Anorganische Chemie,

Georg-August-Universit\"at G\"ottingen,

Tammannstrasse 4, D 37077 G\"ottingen, Germany

;
_publ_contact_author_email       hroesky@gwdg.de
_publ_contact_author_name        'Herbert W. Roesky'
_publ_section_title
;

OH Functionality of Germanium(II) Compounds for the Formation of

Heterobimetallic Oxides

;
_journal_name_full               'Inorganic Chemistry'
_journal_page_first              3537
_journal_page_last               3540
_journal_paper_doi               10.1021/ic048383f
_journal_volume                  44
_journal_year                    2005
_chemical_formula_moiety         LGe(m-O)ZrCp2Me
_chemical_formula_sum            'C40 H54 Ge N2 O Zr'
_chemical_formula_weight         742.66
_chemical_name_systematic
;

?

;
_space_group_IT_number           2
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_atom_sites_solution_primary     direct
_atom_sites_solution_secondary   difmap
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_cell_angle_beta                 89.60(1)
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_cell_measurement_temperature    100(2)
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_computing_cell_refinement       'Bruker AXS SAINT (v 7.01A, Bruker 2003)'
_computing_data_collection       'Proteum (v 1.40, Bruker 2002)'
_computing_data_reduction        'Bruker AXS SAINT (v 7.01A, Bruker 2003)'
_computing_molecular_graphics    'Bruker AXS SHELXTL (v 6.12)'
_computing_publication_material  'SHELXL-97 (Sheldrick, 1997)'
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_computing_structure_solution    'SHELXS-97 (Sheldrick, 1990)'
_diffrn_ambient_temperature      100(2)
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_diffrn_measured_fraction_theta_full 0.966
_diffrn_measured_fraction_theta_max 0.966
_diffrn_measurement_device_type  'Bruker three circle diffractometer'
_diffrn_measurement_method       'phi and omega scan'
_diffrn_radiation_monochromator  'mirror system'
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_diffrn_radiation_type           CuK\a
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_diffrn_reflns_theta_max         58.96
_diffrn_reflns_theta_min         2.24
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_exptl_absorpt_correction_T_max  0.8992
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_exptl_absorpt_correction_type   multi-scan
_exptl_crystal_colour            orange
_exptl_crystal_density_diffrn    1.361
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       plate
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_exptl_crystal_size_max          0.10
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_refine_ls_extinction_expression Fc^*^=kFc[1+0.001xFc^2^\l^3^/sin(2\q)]^-1/4^
_refine_ls_extinction_method     SHELXL
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_refine_ls_number_reflns         5044
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_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'calc w=1/[\s^2^(Fo^2^)+(0.0306P)^2^+2.5234P] where P=(Fo^2^+2Fc^2^)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0728
_refine_ls_wR_factor_ref         0.0735
_reflns_number_gt                4879
_reflns_number_total             5044
_reflns_threshold_expression     >2sigma(I)
_cod_data_source_file            ic048383fsi20041122_032909_2.cif
_cod_data_source_block           LGem-OZrCp2Me
_cod_depositor_comments
;
The following automatic conversions were performed:
'_symmetry_cell_setting' value 'TRICLINIC' changed to 'triclinic'
according to '/home/saulius/struct/CIF-dictionaries/cif_core.dic'
dictionary named 'cif_core.dic' version 2.4.1 from 2010-06-29.

Automatic conversion script
Id: cif_fix_enum 1527 2010-12-29 10:47:43Z saulius 
;
_cod_original_cell_volume        1812(1)
_cod_database_code               1100712