Structures and band gaps of lead-free dabconium-containing hybrid alkali-metal halide perovskites
van der Poll, Hendrik J.; Erasmus, Rudolph; Rademeyer, Melanie; CrystEngComm 27 (2025) 2545–2558; doi:10.1039/D4CE00907J

data_7250165
_publ_section_title
;
 Structures and band gaps of lead-free dabconium-containing hybrid
 alkali-metal halide perovskites
;
_journal_issue                   16
_journal_name_full               CrystEngComm
_journal_page_first              2545
_journal_page_last               2558
_journal_paper_doi               10.1039/D4CE00907J
_journal_volume                  27
_journal_year                    2025
_chemical_formula_moiety         'Br3 Cs, C6 H14 N2'
_chemical_formula_sum            'C6 H14 Br3 Cs N2'
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_space_group_name_Hall           '-P 2n 2ab'
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_audit_update_record
;
2025-02-17 deposited with the CCDC.	2025-03-21 downloaded from the CCDC.
;
_cell_angle_alpha                90
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_computing_cell_refinement       'SAINT (Bruker, 2014)'
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_diffrn_ambient_temperature      150(2)
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_diffrn_measurement_device_type  'Bruker kappa, Photon 100 CMOS'
_diffrn_measurement_method       '\f and \w scans'
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_diffrn_reflns_limit_l_min       -32
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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^)+(0.0422P)^2^+6.3540P] where P=(Fo^2^+2Fc^2^)/3'
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_reflns_threshold_expression     'I > 2\s(I)'
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_cod_data_source_block           DCsBr3
_cod_depositor_comments
'Adding full bibliography for 7250161--7250169.cif.'
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