Visible-light-responsive indoleazopyrazole photoswitches: dual enhancement of redshift and half-life by ester modification at the <i>ortho</i> position.
Yu, Xuanchi; Zhang, Chenyu; Dong, Dongfang; Liu, Bing; Wang, Dali; Li, Tao; Chemical science 16 (2025) 15620–15627; doi:10.1039/d5sc03275j

data_1575168
_publ_section_title
;
 Visible-light-responsive indoleazopyrazole photoswitches: dual
 enhancement of redshift and half-life by ester modification at the
 <i>ortho</i> position.
;
_journal_issue                   34
_journal_name_full               'Chemical science'
_journal_page_first              15620
_journal_page_last               15627
_journal_paper_doi               10.1039/d5sc03275j
_journal_volume                  16
_journal_year                    2025
_chemical_formula_moiety         'C13 H13 N5'
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_audit_update_record
;
2025-02-17 deposited with the CCDC.	2025-07-21 downloaded from the CCDC.
;
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_exptl_absorpt_process_details
;
CrysAlisPro 1.171.43.90a (Rigaku Oxford Diffraction, 2023)
Empirical absorption correction using spherical harmonics,
implemented in SCALE3 ABSPACK scaling algorithm.
;
_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^)+(0.0768P)^2^+0.2241P] where P=(Fo^2^+2Fc^2^)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.1249
_refine_ls_wR_factor_ref         0.1286
_reflns_Friedel_coverage         0.000
_reflns_number_gt                2142
_reflns_number_total             2436
_reflns_threshold_expression     'I > 2\s(I)'
_cod_data_source_file            d5sc03275j2.cif
_cod_data_source_block           t
_cod_depositor_comments
'Adding full bibliography for 1575168--1575171.cif.'
_cod_original_sg_symbol_H-M      'P 21/n'
_cod_database_code               1575168
_shelx_shelxl_version_number     2018/3
_shelx_estimated_absorpt_t_min   0.897
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_shelx_res_checksum              92857