Synthesis and structural analyses of phenylethynyl-substituted tris(2-pyridylmethyl)amines and their copper(ii) complexes.
Lim, Jaebum; Lynch, Vincent M.; Edupuganti, Ramakrishna; Ellington, Andrew; Anslyn, Eric V.; Dalton transactions (Cambridge, England : 2003) 45 (2016) 10585–10598; doi:10.1039/c6dt00473c

data_7039359
_publ_section_title
;
 Synthesis and structural analyses of phenylethynyl-substituted
 tris(2-pyridylmethyl)amines and their copper(ii) complexes.
;
_journal_issue                   26
_journal_name_full
'Dalton transactions (Cambridge, England : 2003)'
_journal_page_first              10585
_journal_page_last               10598
_journal_paper_doi               10.1039/c6dt00473c
_journal_volume                  45
_journal_year                    2016
_chemical_formula_moiety         'C34 H26 N4, Cu 2+, C2 H3 N, 2 Cl O4 1-'
_chemical_formula_sum            'C36 H29 Cl2 Cu N5 O8'
_chemical_formula_weight         794.08
_chemical_name_systematic
;
 ?
;
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_space_group_IT_number           2
_space_group_name_Hall           '-P 1'
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;
2014-10-09 deposited with the CCDC.
2016-05-31 downloaded from the CCDC.
;
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_computing_data_collection       'CrystalClear (Rigaku Inc., 2008)'
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_computing_molecular_graphics    'XP SHELXTL/PC, Siemens Analytical'
_computing_publication_material  'XP SHELXTL/PC, Siemens Analytical'
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_computing_structure_solution
;

SIR97 - Altomare A., Burla M.C., Camalli M., Cascarano G.L., Giacovazzo C., 
Guagliardi A., Moliterni A.G.G., Polidori G.,Spagna R.
;
_diffrn_ambient_temperature      100(2)
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_diffrn_measurement_device_type  'Rigaku AFC-12 with Saturn 724+ CCD'
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_diffrn_source                   'sealed tube'
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_exptl_absorpt_process_details
;
Abscor. T. Higashi (2001). The Rigaku Corporation, Tokyo, Japan.
;
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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^)+(0.0361P)^2^+1.4027P] where P=(Fo^2^+2Fc^2^)/3'
_refine_ls_weighting_scheme      calc
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_reflns_threshold_expression     'I > 2\s(I)'
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'Adding full bibliography for 7039356--7039361.cif.'
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_shelx_res_checksum              93864