Synthesis of isoxazoline-functionalized phenanthridines via iminoxyl radical-participated cascade sequence.
Yang, Xiu-Long; Chen, Fei; Zhou, Neng-Neng; Yu, Wei; Han, Bing; Organic letters 16 (2014) 6476–6479; doi:10.1021/ol503335k

data_1518419
_publ_section_title
;
 Synthesis of isoxazoline-functionalized phenanthridines via iminoxyl
 radical-participated cascade sequence.
;
_journal_issue                   24
_journal_name_full               'Organic letters'
_journal_page_first              6476
_journal_page_last               6479
_journal_paper_doi               10.1021/ol503335k
_journal_volume                  16
_journal_year                    2014
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CrysAlisPro, Agilent Technologies,
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CrysAlisPro, Agilent Technologies,
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CrysAlisPro, Agilent Technologies,
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Superflip (Palatinus & Chapuis, 2007;Palatinus & van der Lee, 2008;
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omega____ theta____ kappa____ phi______ frames
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omega____ theta____ kappa____ phi______ frames
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omega____ theta____ kappa____ phi______ frames
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omega____ theta____ kappa____ phi______ frames
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CrysAlisPro, Agilent Technologies,
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Empirical absorption correction using spherical harmonics,
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 w=1/[\s^2^(Fo^2^)+(0.0782P)^2^+3.6744P]
 where P=(Fo^2^+2Fc^2^)/3
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_cod_data_source_file            ol503335k_si_002.cif
_cod_data_source_block           yangxl0715
_cod_depositor_comments
;
          Adding full bibliography for 1518419.cif.

2017-03-18
Z value and formula fixed to values more according to usual
chemical conventions.                 miguel
;
_cod_original_cell_volume        3826.5(6)
_cod_original_formula_moiety     '2(C25 H22 N2 O)'
_cod_original_formula_sum        'C50 H44 N4 O2'
_cod_original_formula_units_Z    4
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_cod_database_code               1518419
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_olex2_refinement_description
;
1. Fixed Uiso
 At 1.2 times of:
  All C(H) groups, All C(H,H) groups
 At 1.5 times of:
  All C(H,H,H) groups
2.a Ternary CH refined with riding coordinates:
 C15(H15)
2.b Secondary CH2 refined with riding coordinates:
 C14(H14A,H14B)
2.c Aromatic/amide H refined with riding coordinates:
 C3(H3), C4(H4), C5(H5), C6(H6), C9(H9), C10(H10), C11(H11), C12(H12),
 C19(H19), C20(H20), C21(H21), C22(H22), C23(H23)
2.d Idealised Me refined as rotating group:
 C24(H24A,H24B,H24C), C25(H25A,H25B,H25C)
;
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_olex2_submission_special_instructions 'No special instructions were received'