Novel acetoxylation and C-C coupling reactions at unactivated positions in alpha-amino acid derivatives.
Reddy, B. V. Subba; Reddy, Leleti Rajender; Corey, E. J.; Organic letters 8 (2006) 3391–3394; doi:10.1021/ol061389j

data_1506138
_publ_section_title
;
 Novel acetoxylation and C-C coupling reactions at unactivated positions
 in alpha-amino acid derivatives.
;
_journal_issue                   15
_journal_name_full               'Organic letters'
_journal_page_first              3391
_journal_page_last               3394
_journal_paper_doi               10.1021/ol061389j
_journal_volume                  8
_journal_year                    2006
_chemical_formula_moiety         'C30H27N3O4 + C6H6'
_chemical_formula_sum            'C36 H33 N3 O4'
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_cell_length_b                   11.3032(18)
_cell_length_c                   12.902(2)
_cell_measurement_reflns_used    650
_cell_measurement_temperature    193(2)
_cell_measurement_theta_max      20.87
_cell_measurement_theta_min      2.50
_cell_volume                     1482.9(4)
_computing_cell_refinement       'SMART (BRUKER, V5.625, 2001)'
_computing_data_collection       'ASTRO (BRUKER, V5.007, 1997)'
_computing_data_reduction        'SAINT (BRUKER, V6.22, 2001)'
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_computing_publication_material  'XCIF (Sheldrick and BRUKER, 1997, V5.1)'
_computing_structure_refinement  'SHELXL-97 (Sheldrick, 1997)'
_computing_structure_solution    'SHELXS-97 (Sheldrick, 1990)'
_diffrn_ambient_temperature      193(2)
_diffrn_detector_area_resol_mean 836.6
_diffrn_measured_fraction_theta_full 0.997
_diffrn_measured_fraction_theta_max 0.997
_diffrn_measurement_device_type  'Bruker CCD'
_diffrn_measurement_method       '\w, 0.3 deg'
_diffrn_radiation_monochromator  graphite
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_diffrn_reflns_limit_l_min       -14
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_diffrn_standards_interval_count 0
_diffrn_standards_number         0
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_exptl_absorpt_process_details   SADABS
_exptl_crystal_colour            plate
_exptl_crystal_density_diffrn    1.280
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       colorless
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_refine_ls_extinction_method     none
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_refine_ls_number_reflns         5217
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_refine_ls_R_factor_all          0.1157
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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^)+(0.0601P)^2^+0.0000P] where P=(Fo^2^+2Fc^2^)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.1327
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_reflns_number_gt                3190
_reflns_number_total             5217
_reflns_threshold_expression     >2sigma(I)
_cod_data_source_file            ol061389jsi20060607_024934.cif
_cod_data_source_block           ejc119t
_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.

'_exptl_absorpt_correction_type' value 'Empirical'
changed to 'empirical' 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_values 1715 2011-07-08 13:25:40Z adriana 
;
_cod_original_sg_symbol_H-M      P-1
_cod_database_code               1506138