Planar hexaphyrin-like macrocycles turning into bis-BODIPYs with box-shaped structures exhibiting excitonic coupling.
Kalaiselvan, Arumugam; Dhamija, Shaina; Aswathi, Chakrapani; De, Arijit K.; Gokulnath, Sabapathi; Chemical communications (Cambridge, England) 57 (2021) 11485–11488; doi:10.1039/d1cc04403f

data_7129062
_publ_section_title
;
 Planar hexaphyrin-like macrocycles turning into bis-BODIPYs with
 box-shaped structures exhibiting excitonic coupling.
;
_journal_issue                   87
_journal_name_full
'Chemical communications (Cambridge, England)'
_journal_page_first              11485
_journal_page_last               11488
_journal_paper_doi               10.1039/d1cc04403f
_journal_volume                  57
_journal_year                    2021
_chemical_formula_moiety         'C70 H54 B2 F14 N6'
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_audit_update_record
;
2021-01-29 deposited with the CCDC.	2021-10-06 downloaded from the CCDC.
;
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'ORTEP3 (Farrugia, 1997) and Mercury (Bruno et al., 2002)'
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_diffrn_measurement_device_type  'Bruker KAPPA APEX-II CCD'
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_exptl_crystal_colour            violet
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_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
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'w=1/[\s^2^(Fo^2^)+(0.0915P)^2^+8.7234P] where P=(Fo^2^+2Fc^2^)/3'
_refine_ls_weighting_scheme      calc
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_reflns_number_gt                3491
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_reflns_threshold_expression     'I > 2\s(I)'
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_cod_depositor_comments
'Adding full bibliography for 7129062--7129063.cif.'
_cod_original_cell_volume        7098(3)
_cod_original_sg_symbol_H-M      'I 2/a'
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