Macrocyclic effect upon site-selective CuIIMII or MIICuII core formation with unsymmetric phenol-based macrocyclic ligands
Yonemura, Masami; Usuki, Naoki; Nakamura, Yuuki; Ohba, Masaaki; Ōkawa, Hisashi; Journal of the Chemical Society, Dalton Transactions  (2000) 3624–; doi:10.1039/b006605m

data_7010171
_publ_section_title
;
 Macrocyclic effect upon site-selective CuIIMII or MIICuII core
 formation with unsymmetric phenol-based macrocyclic ligands
;
_journal_issue                   20
_journal_name_full
'Journal of the Chemical Society, Dalton Transactions'
_journal_page_first              3624
_journal_paper_doi               10.1039/b006605m
_journal_year                    2000
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_cell_measurement_theta_max      30.58
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_diffrn_radiation_monochromator  graphite
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_diffrn_radiation_type           MoKalpha
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_exptl_absorpt_coefficient_mu_cm 35.652
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_exptl_crystal_colour            dark-brownXDIM
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_refine_ls_structure_factor_coef F
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_cod_data_source_file            b006605m.txt
_cod_data_source_block           '[Cu(L2;4)]_2MeOH_H2O'
_cod_depositor_comments
;
The following automatic conversions were performed:

'_atom_site_thermal_displace_type' tag value 'Uij' was replaced with
'Uani' value 66 times.

Automatic conversion script
Id: cif_fix_values 1646 2011-03-28 12:23:43Z adriana 

The following automatic conversions were performed:
data name '_exptl_crystal_f000' replaced with '_exptl_crystal_F_000'
as specified in the replacement file
'/home/antanas/src/cod-tools/trunk/data/replacement-values/replacement_tags.lst'.

Automatic conversion script
Id: cif_correct_tags 4998 2017-03-02 13:24:31Z antanas 
;
_cod_original_cell_volume        5790(4)
_cod_original_sg_symbol_H-M      'P b c a    '
_cod_database_code               7010171
_exptl_absorpt_process_descript  psi-scan
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_diffrn_reflns_k_min             0
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_diffrn_reflns_l_min             -9
_diffrn_reflns_l_max             0
_diffrn_theta_max                27.5481
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_diffrn_orient_matrix_13         0.00286
_diffrn_orient_matrix_21         0.03925
_diffrn_orient_matrix_22         -0.01355
_diffrn_orient_matrix_23         0.00018
_diffrn_orient_matrix_31         0.00040
_diffrn_orient_matrix_32         0.00072
_diffrn_orient_matrix_33         -0.11168