data_3000047
loop_
_publ_author_name
'Samantha Kruse'
'Stephanie Hurst'
_publ_section_title
;
 Rapid one-pot synthesis of cycloheptatrienyl-phosphonium derivatives
;
_journal_name_full               'To be published in Tetrahedron Letters'
_diffrn_ambient_temperature      150.15
_chemical_formula_sum            'C40 H38 B2 F8 P2'
_symmetry_space_group_name_Hall  '-P 2ac 2ab'
_symmetry_space_group_name_H-M   'P b c a'
_cell_length_a                   13.8462(11)
_cell_length_b                   15.3234(12)
_cell_length_c                   34.197(3)
_cell_angle_alpha                90
_cell_angle_beta                 90
_cell_angle_gamma                90
_cell_volume                     7255.6(10)
_diffrn_radiation_wavelength     0.71073
_diffrn_radiation_type           'Mo K\a'
_refine_ls_R_factor_all          0.0600
_refine_ls_R_factor_gt           0.0412
_refine_ls_wR_factor_gt          0.0951
_refine_ls_wR_factor_ref         0.1058
_refine_ls_goodness_of_fit_ref   1.0479
_cod_hold_until_date             2015-10-13
loop_
_atom_site_label
_atom_site_fract_x
_atom_site_fract_y
_atom_site_fract_z
? ? ? ?
