Catalytic and asymmetric cyclopropanation of alkenes catalysed by rhenium(I) bipyridine and terpyridine tricarbonyl complexes.
Yeung, Chi-Tung; Teng, Pang-Fei; Yeung, Ho-Lun; Wong, Wing-Tak; Kwong, Hoi-Lun; Organic & biomolecular chemistry 5 (2007) 3859–3864; doi:10.1039/b712995e

data_7151191
_publ_section_title
;
 Catalytic and asymmetric cyclopropanation of alkenes catalysed by
 rhenium(I) bipyridine and terpyridine tricarbonyl complexes.
;
_journal_issue                   23
_journal_name_full               'Organic &amp; biomolecular chemistry'
_journal_page_first              3859
_journal_page_last               3864
_journal_paper_doi               10.1039/b712995e
_journal_volume                  5
_journal_year                    2007
_chemical_absolute_configuration ad
_chemical_formula_moiety         'C27 H28 Br N2 O3 Re '
_chemical_formula_sum            'C27 H28 Br N2 O3 Re'
_chemical_formula_weight         694.64
_space_group_IT_number           1
_symmetry_cell_setting           triclinic
_symmetry_Int_Tables_number      1
_symmetry_space_group_name_Hall  'P 1'
_symmetry_space_group_name_H-M   'P 1'
_cell_angle_alpha                76.415(2)
_cell_angle_beta                 85.266(2)
_cell_angle_gamma                81.798(2)
_cell_formula_units_Z            2
_cell_length_a                   9.5930(11)
_cell_length_b                   10.5494(13)
_cell_length_c                   13.618(2)
_cell_measurement_reflns_used    11107
_cell_measurement_temperature    301(1)
_cell_measurement_theta_max      27.5
_cell_measurement_theta_min      1.5
_cell_volume                     1324.2(3)
_computing_cell_refinement       'SAINT (Bruker, 1998)'
_computing_data_collection       'SMART (Bruker, 1998)'
_computing_data_reduction
'SAINT (Bruker, 1998); CrystalStructure (Rigaku/MSC & Rigaku Corporation, 2003)'
_computing_molecular_graphics    'ORTEPII (Johnson, 1976)'
_computing_publication_material  CrystalStructure
_computing_structure_refinement  'CRYSTALS (Watkin et al., 1996)'
_computing_structure_solution    'DIRDIF99 (PATTY)'
_diffrn_measured_fraction_theta_full 0.9512
_diffrn_measured_fraction_theta_max 0.9512
_diffrn_measurement_device_type  'Bruker SMART 1000 CCD'
_diffrn_measurement_method       '\w and \f scan'
_diffrn_radiation_type           'Mo K\a'
_diffrn_radiation_wavelength     0.71073
_diffrn_reflns_av_R_equivalents  0.018
_diffrn_reflns_limit_h_max       11
_diffrn_reflns_limit_h_min       -12
_diffrn_reflns_limit_k_max       12
_diffrn_reflns_limit_k_min       -13
_diffrn_reflns_limit_l_max       17
_diffrn_reflns_limit_l_min       -17
_diffrn_reflns_number            11107
_diffrn_reflns_theta_full        27.48
_diffrn_reflns_theta_max         27.48
_exptl_absorpt_coefficient_mu    6.133
_exptl_absorpt_correction_T_max  0.399
_exptl_absorpt_correction_T_min  0.212
_exptl_absorpt_correction_type   multi-scan
_exptl_absorpt_process_details   'SADABS (Sheldrick, 1997)'
_exptl_crystal_colour            yellow
_exptl_crystal_density_diffrn    1.742
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       prism
_exptl_crystal_F_000             676.00
_exptl_crystal_size_max          0.38
_exptl_crystal_size_mid          0.20
_exptl_crystal_size_min          0.15
_refine_diff_density_max         1.82
_refine_diff_density_min         -0.99
_refine_ls_abs_structure_details 'Flack (1983).  3476 Friedel Pairs'
_refine_ls_abs_structure_Flack   0.076(10)
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.026
_refine_ls_hydrogen_treatment    constr
_refine_ls_number_parameters     670
_refine_ls_number_reflns         8218
_refine_ls_R_factor_gt           0.0280
_refine_ls_shift/su_max          0.0130
_refine_ls_structure_factor_coef F
_refine_ls_weighting_details     'w = 1/[0.0002Fo^2^ + \s(Fo^2^) + 0.035]'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_ref         0.0310
_reflns_number_gt                8201
_reflns_number_total             9270
_reflns_threshold_expression     F^2^>2.0\s(F^2^)
_cod_data_source_file            b712995e-1.txt
_cod_data_source_block           wt1368w
_cod_original_formula_sum        'C27 H28 Br N2 O3 Re '
_cod_database_code               7151191