Syntheses and structures of two coordination polymers formed by Ni(cyclam)2+ cations and sulfate anions
Tsymbal, Liudmyla V.; Andriichuk, Irina L.; Bahrin, Lucian G.; Lampeka, Yaroslaw D.; Acta Crystallographica Section E Crystallographic Communications 81 (2025) –; doi:10.1107/S2056989024012337

data_2023343
_publ_section_title
;
 Syntheses and structures of two coordination polymers formed by
 Ni(cyclam)2+ cations and sulfate anions
;
_journal_coeditor_code           HB8118
_journal_issue                   2
_journal_name_full
'Acta Crystallographica Section E Crystallographic Communications'
_journal_paper_doi               10.1107/S2056989024012337
_journal_volume                  81
_journal_year                    2025
_chemical_formula_iupac          '[Ni (S O4) (C10 H24 N4)]2, C46 H38 O8, 18H2 O'
_chemical_formula_moiety         'C20 H48 N8 Ni2 O8 S2, C46 H38 O8'
_chemical_formula_sum            'C66 H86 N8 Ni2 O16 S2'
_chemical_formula_weight         1428.96
_chemical_name_systematic
;<i>catena</i>-Poly[[[(1,4,8,11-tetraazacyclotetradecane-\k^4^<i>N</i>^1^,<i>N</i>^4^,<i>N</i>^8^,<i>N</i>^11^)nickel(II)]-\m~2~-sulfato-\k^2^<i>O</i>^3^:<i>O</i>^4^]
hemi[4,4',4'',4'''-(2,2',4,4',6,6'-hexamethyl-[1,1'-biphenyl]-3,3',5,5'-tetrayl)tetrabenzoic acid] nonahydrate]
;
_space_group_crystal_system      monoclinic
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;
Olex2 1.3
(compiled 2020.11.12 svn.r5f609507 for OlexSys, GUI svn.r6408)
;
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;
CrysAlisPro (Rigaku OD, 2022)
;
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CrysAlisPro (Rigaku OD, 2022)
;
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CrysAlisPro (Rigaku OD, 2022)
;
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Mercury (Macrae <i>et al.</i>,  2020)
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publCIF (Westrip, 2010)
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<i>SHELXL2018/3</i> (Sheldrick, 2015b)
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<i>SHELXT2018/2</i> (Sheldrick, 2015a)
;
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_diffrn_measurement_device       'four-circle diffractometer'
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;
(CrysAlisPro; Rigaku OD, 2022)
;
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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^)+(0.0206P)^2^] where P=(Fo^2^+2Fc^2^)/3'
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_reflns_threshold_expression     'I > 2\s(I)'
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_cod_database_code               2023343
_shelx_estimated_absorpt_t_min   0.944
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