Tuning carbonyl interactions in dibenzochalcogenophenes
Höfmann, Lea; Wölper, Christoph; Huber, Alexander; Siera, Hannah; Daniliuc, Constantin G.; Haberhauer, Gebhard; Voskuhl, Jens; CrystEngComm 27 (2025) 2902–2909; doi:10.1039/D4CE01248H

data_7250219
_publ_section_title
;
 Tuning carbonyl interactions in dibenzochalcogenophenes
;
_journal_issue                   18
_journal_name_full               CrystEngComm
_journal_page_first              2902
_journal_page_last               2909
_journal_paper_doi               10.1039/D4CE01248H
_journal_volume                  27
_journal_year                    2025
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_atom_sites_solution_secondary   difmap
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_audit_update_record
;
2025-04-02 deposited with the CCDC.	2025-04-03 downloaded from the CCDC.
;
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_diffrn_measured_fraction_theta_max 0.984
_diffrn_measurement_device_type  'Bruker D8 Venture (Photon II detector)'
_diffrn_measurement_method       'Data collection strategy APEX 3/Queen'
_diffrn_radiation_monochromator  'multilayer mirror'
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_diffrn_source                   'micro-focus sealed tube'
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_refine_ls_structure_factor_coef Fsqd
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'w=1/[\s^2^(Fo^2^)+(0.0607P)^2^+1.8054P] where P=(Fo^2^+2Fc^2^)/3'
_refine_ls_weighting_scheme      calc
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_reflns_threshold_expression     'I > 2\s(I)'
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_cod_depositor_comments
'Adding full bibliography for 7250216--7250224.cif.'
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_cod_database_code               7250219
_shelx_shelxl_version_number     2017/1
_shelx_estimated_absorpt_t_min   0.167
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_shelx_res_checksum              58612