Substrate-Triggered Stereoselective Preparation of Highly Substituted Organic Carbonates
Laserna, Victor; Martin, Eddy; Escudero-Adán, Eduardo C.; Kleij, Arjan W.; ACS Catalysis 7 (2017) 5478–; doi:10.1021/acscatal.7b01748

data_4514167
_publ_section_title
;
 Substrate-Triggered Stereoselective Preparation of Highly Substituted
 Organic Carbonates
;
_journal_issue                   8
_journal_name_full               'ACS Catalysis'
_journal_page_first              5478
_journal_paper_doi               10.1021/acscatal.7b01748
_journal_volume                  7
_journal_year                    2017
_chemical_formula_sum            'C7 H10 O4'
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;
 Fullsphere data collection, phi and omega scans
;
_diffrn_measurement_specimen_support 'magnetic support with MicroMount'
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_exptl_absorpt_process_details
; 
 SADABS Version 2008/1 Bruker-Nonius
 Blessing, Acta Cryst. (1995) A51 33-38
;
_exptl_crystal_colour            colourless
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_exptl_crystal_description       block
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_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'w=1/[\s^2^(Fo^2^)+(0.0445P)^2^+0.1980P] where P=(Fo^2^+2Fc^2^)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0965
_refine_ls_wR_factor_ref         0.1005
_reflns_Friedel_coverage         0.000
_reflns_number_gt                1476
_reflns_number_total             1781
_reflns_threshold_expression     'I > 2\s(I)'
_cod_data_source_file            cs7b01748_si_003.cif
_cod_data_source_block           mo_vlab33_0m
_cod_depositor_comments
;
The following automatic conversions were performed:

'_symmetry_cell_setting' value 'Monoclinic' changed to 'monoclinic'
according to
/home/data/users/saulius/crontab/automatic-downloads/rss-feeds/ACS/lib/dictionaries/cif_core.dic
dictionary named 'cif_core.dic' version 2.4.2 from 2011-04-26.

Automatic conversion script
Id: cif_fix_values 4973 2017-02-22 13:04:09Z antanas 

 Adding full bibliography for 4514166--4514168.cif.
;
_cod_original_cell_volume        706.67(19)
_cod_original_sg_symbol_H-M      P2(1)/n
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_shelx_hkl_checksum              95447