Multifunctional Zn(II) Complexes: Photophysical Properties and Catalytic Transesterification toward Biodiesel Synthesis.
Gupta, Abhishek Kumar; Dhir, Abhimanew; Pradeep, Chullikkattil P.; Inorganic chemistry 55 (2016) 7492–7500; doi:10.1021/acs.inorgchem.6b00804

data_4344882
_publ_section_title
;
 Multifunctional Zn(II) Complexes: Photophysical Properties and Catalytic
 Transesterification toward Biodiesel Synthesis.
;
_journal_issue                   15
_journal_name_full               'Inorganic chemistry'
_journal_page_first              7492
_journal_page_last               7500
_journal_paper_doi               10.1021/acs.inorgchem.6b00804
_journal_volume                  55
_journal_year                    2016
_chemical_formula_sum            'C22 H33 Br N2 O14 Zn2'
_chemical_formula_weight         760.15
_chemical_name_systematic
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 ?
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_cell_formula_units_Z            2
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CrysAlisPro, Agilent Technologies,
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CrysAlisPro, Agilent Technologies,
Version 1.171.37.33c (release 11-04-2014 CrysAlis171 .NET)
(compiled Apr 11 2014,15:12:41)
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CrysAlisPro, Agilent Technologies,
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_diffrn_reflns_theta_min         2.332
_diffrn_source                   'SuperNova (Mo) X-ray Source'
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CrysAlisPro, Agilent Technologies,
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Numerical absorption correction based on gaussian integration over
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Empirical absorption correction using spherical harmonics,
 implemented in SCALE3 ABSPACK scaling algorithm.
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_exptl_crystal_colour            yellow
_exptl_crystal_density_diffrn    1.840
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       Block
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_exptl_crystal_size_max          0.2074
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_refine_ls_number_reflns         5481
_refine_ls_number_restraints     2
_refine_ls_restrained_S_all      0.995
_refine_ls_R_factor_all          0.0838
_refine_ls_R_factor_gt           0.0472
_refine_ls_shift/su_max          0.012
_refine_ls_shift/su_mean         0.001
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'w=1/[\s^2^(Fo^2^)+(0.0767P)^2^] where P=(Fo^2^+2Fc^2^)/3'
_refine_ls_weighting_scheme      calc
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_refine_ls_wR_factor_ref         0.1548
_reflns_Friedel_coverage         0.000
_reflns_number_gt                3396
_reflns_number_total             5481
_reflns_threshold_expression     'I > 2\s(I)'
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'Adding full bibliography for 4344880--4344882.cif.'
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