Asymmetric synthesis of both enantiomers of arteludovicinolide A.
Kreuzer, Andreas; Kerres, Sabine; Ertl, Thomas; Rücker, Hannelore; Amslinger, Sabine; Reiser, Oliver; Organic letters 15 (2013) 3420–3423; doi:10.1021/ol401473v

data_1556203
_publ_section_title
;
 Asymmetric synthesis of both enantiomers of arteludovicinolide A.
;
_journal_issue                   13
_journal_name_full               'Organic letters'
_journal_page_first              3420
_journal_page_last               3423
_journal_paper_doi               10.1021/ol401473v
_journal_volume                  15
_journal_year                    2013
_chemical_compound_source        'see text'
_chemical_formula_moiety         'C25 H42 O5 Si'
_chemical_formula_sum            'C25 H42 O5 Si'
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_space_group_name_Hall           '-P 2ybc'
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_symmetry_space_group_name_Hall  '-P 2ybc'
_symmetry_space_group_name_H-M   'P 1 21/c 1'
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_computing_cell_refinement
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CrysAlisPro, Agilent Technologies,
Version 171.36.21 (release 14-08-2012 CrysAlis171 .NET)
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_computing_data_collection
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CrysAlisPro, Agilent Technologies,
Version 171.36.21 (release 14-08-2012 CrysAlis171 .NET)
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_computing_data_reduction
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CrysAlisPro, Agilent Technologies,
Version 171.36.21 (release 14-08-2012 CrysAlis171 .NET)
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_computing_molecular_graphics    'PLATON (Spek, 1990)'
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_computing_structure_solution    'SIR-97 (Altomare, 1999)'
_diffrn_ambient_temperature      123.0(2)
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_diffrn_measured_fraction_theta_full 0.966
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_diffrn_reflns_reduction_process
;
;
_diffrn_reflns_theta_full        63.32
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_exptl_absorpt_coefficient_mu    1.060
_exptl_absorpt_correction_T_max  1.00000
_exptl_absorpt_correction_T_min  0.72996
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CrysAlisPro, Oxford Diffraction Ltd.,
Version 1.171.33.55 (release 05-01-2010 CrysAlis171 .NET)
Empirical absorption correction using spherical harmonics,
 implemented in SCALE3 ABSPACK scaling algorithm.
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_exptl_crystal_colour            'translucent colourless'
_exptl_crystal_density_diffrn    1.173
_exptl_crystal_density_method    'Not Measured'
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_exptl_crystal_F_000             984
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_exptl_crystal_size_mid          0.05
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_refine_ls_shift/su_max          0.000
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'calc w=1/[\s^2^(Fo^2^)+(0.0576P)^2^+0.9324P] where P=(Fo^2^+2Fc^2^)/3'
_refine_ls_weighting_scheme      calc
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_reflns_number_total             4016
_reflns_threshold_expression     I>2\s(I)
_cod_data_source_file            ol401473v_si_002.cif
_cod_data_source_block           m024
_cod_depositor_comments
;
The following automatic conversions were performed:

data item '_symmetry_cell_setting' value 'Monoclinic' was changed to
'monoclinic' in accordance with the
/home/saulius/struct/COD-crude-data/automatic-downloads/DataCite-retrospective/ACS/depositions/lib/dictionaries/cif_core.dic
dictionary named 'cif_core.dic' version 2.4.2 last updated on
2011-04-26.

Automatic conversion script
Id: cif_fix_values 6909 2019-04-08 15:41:33Z antanas 
;
_cod_original_sg_symbol_H-M      'P 21/c'
_cod_database_code               1556203