Bidentate Ru(ii)-NC complexes as catalysts for the dehydrogenative reaction from primary alcohols to carboxylic acids.
Gong, Dawei; Hu, Bowen; Chen, Dafa; Dalton transactions (Cambridge, England : 2003) 48 (2019) 8826–8834; doi:10.1039/c9dt01414d

data_7700028
_publ_section_title
;
 Bidentate Ru(ii)-NC complexes as catalysts for the dehydrogenative
 reaction from primary alcohols to carboxylic acids.
;
_journal_issue                   24
_journal_name_full
'Dalton transactions (Cambridge, England : 2003)'
_journal_page_first              8826
_journal_page_last               8834
_journal_paper_doi               10.1039/c9dt01414d
_journal_volume                  48
_journal_year                    2019
_chemical_formula_moiety         'C51 H40 Cl N O P2 Ru'
_chemical_formula_sum            'C51 H40 Cl N O P2 Ru'
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_space_group_name_Hall           '-P 1'
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_symmetry_space_group_name_Hall  '-P 1'
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Olex2 1.2
(compiled 2018.05.29 svn.r3508 for OlexSys, GUI svn.r5506)
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2019-01-14 deposited with the CCDC.    2019-05-17 downloaded from the CCDC.
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_diffrn_radiation_type           MoK\a
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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            yellow
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'w=1/[\s^2^(Fo^2^)+(0.0432P)^2^+0.7808P] where P=(Fo^2^+2Fc^2^)/3'
_refine_ls_weighting_scheme      calc
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'Adding full bibliography for 7700028--7700029.cif.'
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_olex2_refinement_description
;
1. Fixed Uiso
 At 1.2 times of:
  All C(H) groups, All C(H,H) groups
2.a Secondary CH2 refined with riding coordinates:
 C2(H2A,H2B)
2.b Aromatic/amide H refined with riding coordinates:
 C30(H30), C20(H20), C18(H18), C32(H32), C49(H49), C29(H29), C16(H16),
 C13(H13), C48(H48), C42(H42), C28(H28), C26(H26), C50(H50), C46(H46), C22(H22),
  C38(H38), C11(H11), C25(H25), C19(H19), C47(H47), C17(H17), C31(H31),
 C40(H40), C44(H44), C24(H24), C43(H43), C23(H23), C37(H37), C41(H41), C12(H12),
  C4(H4), C7(H7), C14(H14), C34(H34), C35(H35), C6(H6), C5(H5), C36(H36)
;
_shelx_res_checksum              74046
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_olex2_submission_special_instructions 'No special instructions were received'