Sustainability by design: automated nanoscale 2,3,4-trisubstituted quinazoline diversity
Hadian, Mojgan; Shaabani, Shabnam; Patil, Pravin; Shishkina, Svitlana V.; Böltz, Harry; Dömling, Alexander; Green Chemistry 22 (2020) 2459–2467; doi:10.1039/D0GC00363H

data_7240445
_publ_section_title
;
 Sustainability by design: automated nanoscale 2,3,4-trisubstituted
 quinazoline diversity
;
_journal_issue                   8
_journal_name_full               'Green Chemistry'
_journal_page_first              2459
_journal_page_last               2467
_journal_paper_doi               10.1039/D0GC00363H
_journal_volume                  22
_journal_year                    2020
_chemical_formula_sum            'C19 H23 N3 O3'
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;
2019-12-17 deposited with the CCDC.	2020-02-21 downloaded from the CCDC.
;
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;
CrysAlisPro 1.171.39.46 (Rigaku Oxford Diffraction, 2018)
Empirical absorption correction using spherical harmonics,
 implemented in SCALE3 ABSPACK scaling algorithm.
;
_exptl_crystal_colour            colorless
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_refine_ls_structure_factor_coef Fsqd
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'w=1/[\s^2^(Fo^2^)+(0.0342P)^2^] where P=(Fo^2^+2Fc^2^)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.1287
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_reflns_threshold_expression     'I > 2\s(I)'
_cod_data_source_file            d0gc00363h2.cif
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_cod_depositor_comments
'Adding full bibliography for 7240443--7240446.cif.'
_cod_original_cell_volume        1815.1(10)
_cod_original_sg_symbol_H-M      'P 21/c'
_cod_database_code               7240445
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