Synthesis, structures, and DFT analysis of gold complexes containing a thiosemicarbazone ligand
Mageed, Ahmed Hassoon; Al-Ameed, Karrar; New Journal of Chemistry 45 (2021) 18433–18442; doi:10.1039/D1NJ03647E

data_7060939
_publ_section_title
;
 Synthesis, structures, and DFT analysis of gold complexes containing a
 thiosemicarbazone ligand
;
_journal_issue                   39
_journal_name_full               'New Journal of Chemistry'
_journal_page_first              18433
_journal_page_last               18442
_journal_paper_doi               10.1039/D1NJ03647E
_journal_volume                  45
_journal_year                    2021
_chemical_formula_moiety         'C8 H10 Au Cl N4 S, Cl, C H4 O'
_chemical_formula_sum            'C9 H14 Au Cl2 N4 O S'
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;
2021-04-22 deposited with the CCDC.	2021-09-06 downloaded from the CCDC.
;
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'CrysAlisPro convention (1999,Acta A55,543-557)'
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;
CrysAlisPro 1.171.38.46 (Rigaku Oxford Diffraction, 2015)
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)
;
_exptl_crystal_colour            colorless
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_refine_ls_structure_factor_coef Fsqd
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'w=1/[\s^2^(Fo^2^)+(0.0300P)^2^] where P=(Fo^2^+2Fc^2^)/3'
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_refine_ls_wR_factor_gt          0.0781
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_reflns_threshold_expression     'I > 2\s(I)'
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_cod_depositor_comments
'Adding full bibliography for 7060937--7060939.cif.'
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