Heptamethylindenyl (Ind*) enables diastereoselective benzamidation of cyclopropenes via Rh(iii)-catalyzed C-H activation.
Semakul, Natthawat; Jackson, Kelvin E.; Paton, Robert S.; Rovis, Tomislav; Chemical science 8 (2017) 1015–1020; doi:10.1039/c6sc02587k

data_1544196
_publ_section_title
;
 Heptamethylindenyl (Ind*) enables diastereoselective benzamidation of
 cyclopropenes via Rh(iii)-catalyzed C-H activation.
;
_journal_issue                   2
_journal_name_full               'Chemical science'
_journal_page_first              1015
_journal_page_last               1020
_journal_paper_doi               10.1039/c6sc02587k
_journal_volume                  8
_journal_year                    2017
_chemical_formula_moiety         'C18 H17 N O2'
_chemical_formula_sum            'C18 H17 N O2'
_chemical_formula_weight         279.32
_space_group_crystal_system      monoclinic
_space_group_IT_number           14
_space_group_name_Hall           '-P 2yn'
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_symmetry_space_group_name_Hall  '-P 2yn'
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Olex2 1.2
(compiled 2016.02.19 svn.r3266 for OlexSys, GUI svn.r5155)
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;
2016-04-07 deposited with the CCDC.
2016-09-16 downloaded from the CCDC.
;
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_computing_molecular_graphics    'Olex2 (Dolomanov et al., 2009)'
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'w=1/[\s^2^(Fo^2^)+(0.0840P)^2^+0.2020P] where P=(Fo^2^+2Fc^2^)/3'
_refine_ls_weighting_scheme      calc
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_cod_data_source_file            c6sc02587k3.cif
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_cod_depositor_comments
;Adding full bibliography for 1544196.cif.

 Adding full bibliography for 1544196.cif.
;
_cod_database_code               1544196
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_olex2_refinement_description
;
1. Fixed Uiso
 At 1.2 times of:
  All C(H) groups, All N(H) groups
 At 1.5 times of:
  All C(H,H,H) groups
2.a Ternary CH refined with riding coordinates:
 C7(H7), C8(H8)
2.b Aromatic/amide H refined with riding coordinates:
 N3(H3), C4(H4), C13(H13), C14(H14), C16(H16), C17(H17), C18(H18), C19(H19),
 C20(H20)
2.c Idealised Me refined as rotating group:
 C15(H15A,H15B,H15C), C21(H21A,H21B,H21C)
;
_shelx_res_checksum              54134
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_olex2_submission_original_sample_id Rovis227
_olex2_submission_special_instructions 'No special instructions were received'