Signaling preferences of substituted pyrrole coupled six-membered rhodamine spirocyclic probes for Hg(2+) ion detection.
Biswal, Biswonath; Mallick, Debajani; Bag, Bamaprasad; Organic & biomolecular chemistry 14 (2016) 2241–2248; doi:10.1039/c5ob02606g

data_7154874
_publ_section_title
;
 Signaling preferences of substituted pyrrole coupled six-membered
 rhodamine spirocyclic probes for Hg(2+) ion detection.
;
_journal_issue                   7
_journal_name_full               'Organic &amp; biomolecular chemistry'
_journal_page_first              2241
_journal_page_last               2248
_journal_paper_doi               10.1039/c5ob02606g
_journal_volume                  14
_journal_year                    2016
_chemical_formula_sum            'C34 H37 N3 O2'
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_space_group_name_Hall           '-P 2yn'
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_audit_update_record
;
2014-11-07 deposited with the CCDC.
2016-01-07 downloaded from the CCDC.
;
_cell_angle_alpha                90
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_computing_structure_refinement  'SHELXL-2013 (Sheldrick, 2013)'
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_exptl_crystal_colour            'Pale Red'
_exptl_crystal_density_diffrn    1.184
_exptl_crystal_description       Rectangular-parallelopiped
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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^)+(0.0832P)^2^+4.2785P] where P=(Fo^2^+2Fc^2^)/3'
_refine_ls_weighting_scheme      calc
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_reflns_threshold_expression     'I > 2\s(I)'
_cod_data_source_file            c5ob02606g2.cif
_cod_data_source_block           BPB-L
_cod_depositor_comments          'Adding full bibliography for 7154874.cif.'
_cod_database_code               7154874
_shelx_estimated_absorpt_t_min   0.989
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