Deposition of CdSe thin films using a novel single-source precursor; [MeCd{(SePiPr2)2N}]2
Afzaal, Mohammmad; Crouch, David; Malik, Mohammad A.; Motevalli, Majid; O'Brien, Paul; Park, Jin-Ho; Journal of Materials Chemistry 13 (2003) 639–; doi:10.1039/b300608p

data_7204599
_publ_section_title
;
 Deposition of CdSe thin films using a novel single-source precursor;
 [MeCd{(SePiPr2)2N}]2
;
_journal_issue                   4
_journal_name_full               'Journal of Materials Chemistry'
_journal_page_first              639
_journal_paper_doi               10.1039/b300608p
_journal_volume                  13
_journal_year                    2003
_chemical_formula_sum            'C26 H62 Cd2 N2 P4 Se4'
_chemical_formula_weight         1067.30
_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                103.44(8)
_cell_angle_beta                 80.97(9)
_cell_angle_gamma                111.88(9)
_cell_formula_units_Z            1
_cell_length_a                   9.625(8)
_cell_length_b                   10.143(9)
_cell_length_c                   11.180(9)
_cell_measurement_temperature    160(2)
_cell_volume                     982.1(16)
_computing_structure_refinement  'SHELXL-97 (Sheldrick, 1997)'
_diffrn_ambient_temperature      160(2)
_diffrn_measured_fraction_theta_full 0.997
_diffrn_measured_fraction_theta_max 0.997
_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  0.0149
_diffrn_reflns_av_sigmaI/netI    0.0263
_diffrn_reflns_limit_h_max       11
_diffrn_reflns_limit_h_min       -11
_diffrn_reflns_limit_k_max       11
_diffrn_reflns_limit_k_min       -12
_diffrn_reflns_limit_l_max       13
_diffrn_reflns_limit_l_min       0
_diffrn_reflns_number            3715
_diffrn_reflns_theta_full        24.98
_diffrn_reflns_theta_max         24.98
_diffrn_reflns_theta_min         1.88
_exptl_absorpt_coefficient_mu    4.971
_exptl_absorpt_correction_T_max  0.6363
_exptl_absorpt_correction_T_min  0.2132
_exptl_crystal_density_diffrn    1.805
_exptl_crystal_density_method    'not measured'
_exptl_crystal_F_000             524
_exptl_crystal_size_max          0.45
_exptl_crystal_size_mid          0.35
_exptl_crystal_size_min          0.10
_refine_diff_density_max         0.951
_refine_diff_density_min         -1.260
_refine_diff_density_rms         0.118
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.038
_refine_ls_hydrogen_treatment    mixed
_refine_ls_matrix_type           full
_refine_ls_number_parameters     181
_refine_ls_number_reflns         3449
_refine_ls_number_restraints     0
_refine_ls_restrained_S_all      1.038
_refine_ls_R_factor_all          0.0409
_refine_ls_R_factor_gt           0.0283
_refine_ls_shift/su_max          0.065
_refine_ls_shift/su_mean         0.001
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'calc w=1/[\s^2^(Fo^2^)+(0.0491P)^2^+0.5274P] where P=(Fo^2^+2Fc^2^)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0705
_refine_ls_wR_factor_ref         0.0745
_reflns_number_gt                2931
_reflns_number_total             3449
_reflns_threshold_expression     >2sigma(I)
_cod_data_source_file            b300608p.txt
_cod_data_source_block           ma3
_cod_original_cell_volume        982.1(14)
_cod_database_code               7204599