Addition of aluminium, zinc and magnesium hydrides to rhodium(iii)
Ekkert, Olga; White, Andrew J. P.; Toms, Harold; Crimmin, Mark R.; Chem. Sci. 6 (2015) 5617–; doi:10.1039/C5SC01309G

data_1520749
_publ_section_title
;
 Addition of aluminium, zinc and magnesium hydrides to rhodium(iii)
;
_journal_issue                   10
_journal_name_full               'Chem. Sci.'
_journal_page_first              5617
_journal_paper_doi               10.1039/C5SC01309G
_journal_volume                  6
_journal_year                    2015
_chemical_formula_moiety         'C45 H73 Mg N2 Rh Si'
_chemical_formula_sum            'C45 H73 Mg N2 Rh Si'
_chemical_formula_weight         797.36
_chemical_name_systematic
; 
 ? 
;
_space_group_crystal_system      triclinic
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_space_group_name_Hall           '-P 1'
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_atom_sites_solution_hydrogens   mixed
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_audit_update_record
;
2015-03-30 deposited with the CCDC.
2015-07-03 downloaded from the CCDC.
;
_cell_angle_alpha                77.684(4)
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_computing_cell_refinement       'CrysAlisPro, Agilent Technologies'
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_computing_structure_solution    'SHELXS-2013 (Sheldrick, 2013)'
_diffrn_ambient_temperature      173
_diffrn_detector_area_resol_mean 16.0382
_diffrn_measured_fraction_theta_full 0.986
_diffrn_measured_fraction_theta_max 0.793
_diffrn_measurement_device_type  'Agilent Xcalibur 3 E'
_diffrn_measurement_method       'omega scans'
_diffrn_radiation_type           MoK\a
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_diffrn_reflns_av_R_equivalents  0.0250
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_diffrn_reflns_laue_measured_fraction_full 0.986
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_diffrn_source                   'Enhance (Mo) X-ray Source'
_exptl_absorpt_coefficient_mu    0.460
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; 
CrysAlisPro, Agilent Technologies, 
Version 1.171.37.33a (release 28-03-2014 CrysAlis171 .NET) 
(compiled Mar 28 2014,12:25:20) 
Analytical numeric absorption correction using a multifaceted crystal 
model based on expressions derived by R.C. Clark & J.S. Reid. 
(Clark, R. C. & Reid, J. S. (1995). Acta Cryst. A51, 887-897) 
Empirical absorption correction using spherical harmonics, 
implemented in SCALE3 ABSPACK scaling algorithm. 
;
_exptl_crystal_colour            'Pale yellow'
_exptl_crystal_density_diffrn    1.202
_exptl_crystal_description       'platy needles'
_exptl_crystal_F_000             856
_exptl_crystal_size_max          0.53
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_exptl_crystal_size_min          0.04
_refine_diff_density_max         0.339
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_refine_ls_number_reflns         8666
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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^)+(0.0226P)^2^+1.0769P] where P=(Fo^2^+2Fc^2^)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.0691
_refine_ls_wR_factor_ref         0.0733
_reflns_Friedel_coverage         0.000
_reflns_number_gt                7414
_reflns_number_total             8666
_reflns_threshold_expression     'I > 2\s(I)'
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_cod_data_source_block           3
_cod_depositor_comments
'Adding full bibliography for 1520747--1520750.cif.'
_cod_database_code               1520749
_shelxl_version_number           2013-4