A one-pot multicomponent strategy for stereospecific construction of tricyclic pyrrolo[1,2-a]quinolines
Tuan-Jie Li; Hong-Mei Yin; Chang-Sheng Yao; Xiang-Shan Wang; Bo Jiang; Shujiang Tu; Guigen Li; Chem.Commun. 48 (2012) 11966–; doi:10.1039/c2cc37066b

data_7108658
_publ_section_title
;
 A one-pot multicomponent strategy for stereospecific construction of
 tricyclic pyrrolo[1,2-a]quinolines
;
_journal_name_full               Chem.Commun.
_journal_page_first              11966
_journal_paper_doi               10.1039/c2cc37066b
_journal_volume                  48
_journal_year                    2012
_chemical_formula_sum            'C82 H70 Cl4 N8 O5'
_chemical_formula_weight         1389.26
_chemical_name_systematic
;
?
;
_space_group_IT_number           2
_symmetry_space_group_name_Hall  '-P 1'
_symmetry_space_group_name_H-M   'P -1'
_atom_sites_solution_hydrogens   geom
_atom_sites_solution_primary     direct
_atom_sites_solution_secondary   difmap
_audit_creation_method           SHELXL-97
_cell_angle_alpha                94.892(3)
_cell_angle_beta                 90.356(4)
_cell_angle_gamma                94.067(4)
_cell_formula_units_Z            2
_cell_length_a                   10.186(3)
_cell_length_b                   11.139(3)
_cell_length_c                   31.748(8)
_cell_measurement_temperature    296(2)
_cell_volume                     3579.8(17)
_computing_structure_refinement  'SHELXL-97 (Sheldrick, 1997)'
_computing_structure_solution    'SHELXS-97 (Sheldrick, 1990)'
_diffrn_ambient_temperature      296(2)
_diffrn_measured_fraction_theta_full 0.983
_diffrn_measured_fraction_theta_max 0.983
_diffrn_radiation_monochromator  graphite
_diffrn_radiation_source         'fine-focus sealed tube'
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71073
_diffrn_reflns_av_R_equivalents  0.0369
_diffrn_reflns_av_sigmaI/netI    0.0605
_diffrn_reflns_limit_h_max       12
_diffrn_reflns_limit_h_min       -11
_diffrn_reflns_limit_k_max       13
_diffrn_reflns_limit_k_min       -13
_diffrn_reflns_limit_l_max       37
_diffrn_reflns_limit_l_min       -35
_diffrn_reflns_number            25085
_diffrn_reflns_theta_full        25.00
_diffrn_reflns_theta_max         25.00
_diffrn_reflns_theta_min         0.64
_exptl_absorpt_coefficient_mu    0.224
_exptl_absorpt_correction_T_max  0.9607
_exptl_absorpt_correction_T_min  0.9481
_exptl_crystal_density_diffrn    1.289
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       block
_exptl_crystal_F_000             1452
_exptl_crystal_size_max          0.24
_exptl_crystal_size_mid          0.21
_exptl_crystal_size_min          0.18
_refine_diff_density_max         1.021
_refine_diff_density_min         -0.641
_refine_diff_density_rms         0.176
_refine_ls_extinction_coef       0.040(3)
_refine_ls_extinction_expression Fc^*^=kFc[1+0.001xFc^2^\l^3^/sin(2\q)]^-1/4^
_refine_ls_extinction_method     SHELXL
_refine_ls_goodness_of_fit_ref   1.048
_refine_ls_hydrogen_treatment    constr
_refine_ls_matrix_type           full
_refine_ls_number_parameters     900
_refine_ls_number_reflns         12387
_refine_ls_number_restraints     16
_refine_ls_restrained_S_all      1.051
_refine_ls_R_factor_all          0.1224
_refine_ls_R_factor_gt           0.0882
_refine_ls_shift/su_max          0.029
_refine_ls_shift/su_mean         0.002
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'calc w=1/[\s^2^(Fo^2^)+(0.1866P)^2^+0.0000P] where P=(Fo^2^+2Fc^2^)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.2415
_refine_ls_wR_factor_ref         0.2730
_reflns_number_gt                8357
_reflns_number_total             12387
_reflns_threshold_expression     >2sigma(I)
_cod_data_source_file            c2cc37066b.txt
_cod_data_source_block           1
_cod_original_cell_volume        3579.7(16)
_cod_database_code               7108658