Porosity control in pillar-layered MOF architectures: hydrogen bonding in amino-functionalized 2-D layers
Tavakoli-Quchani, Fatemeh; Salimi, Alireza; Pour, Ali Nakhaei; CrystEngComm 26 (2024) 4708–4719; doi:10.1039/D4CE00503A

data_7249121
_publ_section_title
;
 Porosity control in pillar-layered MOF architectures: hydrogen bonding in
 amino-functionalized 2-D layers
;
_journal_issue                   34
_journal_name_full               CrystEngComm
_journal_page_first              4708
_journal_page_last               4719
_journal_paper_doi               10.1039/D4CE00503A
_journal_volume                  26
_journal_year                    2024
_chemical_formula_sum            'C110 H84 N18 O26 Zn4'
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_space_group_name_Hall           '-P 2n 2ab'
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_audit_update_record
;
2023-12-15 deposited with the CCDC.	2024-07-22 downloaded from the CCDC.
;
_cell_angle_alpha                90
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_cell_angle_gamma                90
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_cell_length_b                   19.7177(13)
_cell_length_c                   39.988(3)
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;
X-Area Recipe 1.33.0.0 (STOE, 2015)
;
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;
X-Area Pilatus3_SV 1.31.131.0 (STOE, 2017)
;
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;
X-Area Integrate 1.71.0.0 (STOE, 2016)
X-Area LANA 1.71.4.0 (STOE, 2017)
;
_computing_molecular_graphics    'PLATON (Spek, 2009)'
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_diffrn_reflns_Laue_measured_fraction_full 1.000
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_diffrn_reflns_theta_max         25.387
_diffrn_reflns_theta_min         1.219
_diffrn_source                   'sealed x-ray tube'
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_exptl_absorpt_process_details
;
STOE LANA, absorption correction by scaling of reflection intensities.
J. Koziskova, F. Hahn, J. Richter, J. Kozisek, "Comparison of different
absorption corrections on the model structure of tetrakis(\m~2~-acetato)-
diaqua-di-copper(II)", Acta Chimica Slovaca, vol. 9, no. 2, 2016, pp. 136 - 140.
;
_exptl_crystal_colour            yellow
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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^)+(0.1765P)^2^+894.6780P] where P=(Fo^2^+2Fc^2^)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.4143
_refine_ls_wR_factor_ref         0.4361
_reflns_Friedel_coverage         0.000
_reflns_number_gt                14941
_reflns_number_total             21998
_reflns_threshold_expression     'I > 2\s(I)'
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_cod_depositor_comments
'Adding full bibliography for 7249119--7249121.cif.'
_cod_database_code               7249121
_shelx_shelxl_version_number     2014/7
_shelx_res_checksum              26925
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