A new class of azadipnictiridines generated by an unusual rearrangement reaction.
Hinz, Alexander; Schulz, Axel; Seidel, Wolfram W.; Villinger, Alexander; Inorganic chemistry 53 (2014) 11682–11690; doi:10.1021/ic501905v

data_4341339
_publ_section_title
;
 A new class of azadipnictiridines generated by an unusual rearrangement
 reaction.
;
_journal_issue                   21
_journal_name_full               'Inorganic chemistry'
_journal_page_first              11682
_journal_page_last               11690
_journal_paper_doi               10.1021/ic501905v
_journal_volume                  53
_journal_year                    2014
_chemical_formula_moiety         'C50 H52 N2 P2'
_chemical_formula_sum            'C50 H52 N2 P2'
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_symmetry_cell_setting           monoclinic
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_symmetry_space_group_name_Hall  '-P 2yn'
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_cell_angle_beta                 106.707(2)
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_cell_length_a                   12.5531(5)
_cell_length_b                   21.0733(8)
_cell_length_c                   15.9788(6)
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_cell_measurement_temperature    173(2)
_cell_measurement_theta_max      52.956
_cell_measurement_theta_min      4.693
_cell_volume                     4048.5(3)
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_diffrn_ambient_temperature      173(2)
_diffrn_measured_fraction_theta_full 0.999
_diffrn_measured_fraction_theta_max 0.999
_diffrn_measurement_device_type  'Bruker Apex Kappa II-CCD-diffractometer'
_diffrn_measurement_method       'phi and omega scans'
_diffrn_radiation_monochromator  graphite
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_diffrn_reflns_limit_k_min       -29
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_exptl_crystal_colour            colourless
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_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       block
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_refine_ls_number_reflns         11815
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_refine_ls_R_factor_all          0.0954
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_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'calc w=1/[\s^2^(Fo^2^)+(0.0540P)^2^+1.4041P] where P=(Fo^2^+2Fc^2^)/3'
_refine_ls_weighting_scheme      calc
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_cod_data_source_block           ah071a
_cod_depositor_comments
'Adding full bibliography for 4341335--4341344.cif.'
_cod_original_sg_symbol_H-M      'P 21/n'
_cod_database_code               4341339