Cyclopalladation of a ferrocene acylphosphine and the reactivity of the C-H activated products.
Vosáhlo, Petr; Schulz, Jiří; Císařová, Ivana; Štěpnička, Petr; Dalton transactions (Cambridge, England : 2003) 50 (2021) 6232–6244; doi:10.1039/d1dt00668a

data_7706933
_publ_section_title
;
 Cyclopalladation of a ferrocene acylphosphine and the reactivity of the
 C-H activated products.
;
_journal_issue                   18
_journal_name_full
'Dalton transactions (Cambridge, England : 2003)'
_journal_page_first              6232
_journal_page_last               6244
_journal_paper_doi               10.1039/d1dt00668a
_journal_volume                  50
_journal_year                    2021
_chemical_formula_moiety         'C26 H27 Fe I O P2 Pd, 0.5(C4 H8 O2)'
_chemical_formula_sum            'C28 H31 Fe I O2 P2 Pd'
_chemical_formula_weight         750.62
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_space_group_name_Hall           '-P 1'
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_audit_update_record
;
2021-03-19 deposited with the CCDC.	2021-03-23 downloaded from the CCDC.
;
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_cell_measurement_reflns_used    9870
_cell_measurement_temperature    120(2)
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_cell_volume                     1387.41(7)
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_diffrn_ambient_temperature      120(2)
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_diffrn_measured_fraction_theta_max 0.998
_diffrn_measurement_device_type  'Bruker D8 VENTURE Kappa Duo PHOTON 100 CMOS'
_diffrn_measurement_method       '\f and \w scans'
_diffrn_radiation_monochromator  'Quazar Mo multilayer optic'
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_exptl_absorpt_correction_type   multi-scan
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_exptl_crystal_description       plate
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_refine_ls_extinction_method     none
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_refine_ls_R_factor_all          0.0156
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_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'w=1/[\s^2^(Fo^2^)+(0.0104P)^2^+1.2764P] where P=(Fo^2^+2Fc^2^)/3'
_refine_ls_weighting_scheme      calc
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_reflns_number_gt                6186
_reflns_number_total             6336
_reflns_threshold_expression     'I > 2\s(I)'
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_cod_depositor_comments
'Adding full bibliography for 7706929--7706948.cif.'
_cod_database_code               7706933
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_shelx_estimated_absorpt_t_min   0.594
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