Discrete and polymeric cobalt organophosphates: isolation of a 3-D cobalt phosphate framework exhibiting selective CO2 capture.
Gupta, Sandeep K.; Kuppuswamy, Subramaniam; Walsh, James P. S.; McInnes, Eric J. L.; Murugavel, Ramaswamy; Dalton transactions (Cambridge, England : 2003) 44 (2015) 5587–5601; doi:10.1039/c4dt03379e

data_7033896
_publ_section_title
;
 Discrete and polymeric cobalt organophosphates: isolation of a 3-D cobalt
 phosphate framework exhibiting selective CO2 capture.
;
_journal_issue                   12
_journal_name_full
'Dalton transactions (Cambridge, England : 2003)'
_journal_page_first              5587
_journal_page_last               5601
_journal_paper_doi               10.1039/c4dt03379e
_journal_volume                  44
_journal_year                    2015
_chemical_formula_moiety         'C44 H56 Co1 N4 O8 P2'
_chemical_formula_sum            'C44 H56 Co N4 O8 P2'
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_symmetry_space_group_name_Hall  '-P 1'
_symmetry_space_group_name_H-M   'P -1'
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_audit_update_record
;
2015-01-23 deposited with the CCDC.
2015-02-03 downloaded from the CCDC.
;
_cell_angle_alpha                82.120(6)
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_cell_angle_gamma                68.922(6)
_cell_formula_units_Z            1
_cell_length_a                   9.3002(8)
_cell_length_b                   9.6080(8)
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_cell_measurement_theta_min      3.1
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;
CrysAlis RED, Oxford Diffraction Ltd.,
Version 1.171.31.7 (release 18-10-2006 CrysAlis171 .NET)
(compiled Oct 18 2006,16:28:17)
;
_computing_data_collection
;
CrysAlis CCD, Oxford Diffraction Ltd.,
Version 1.171.31.7 (release 18-10-2006 CrysAlis171 .NET)
(compiled Oct 18 2006,16:28:17)
;
_computing_data_reduction
;
CrysAlis RED, Oxford Diffraction Ltd.,
Version 1.171.31.7 (release 18-10-2006 CrysAlis171 .NET)
(compiled Oct 18 2006,16:28:17)
;
_computing_molecular_graphics    'Ortep-3 for Windows (Farrugia, 1997)'
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_diffrn_ambient_temperature      133(2)
_diffrn_measured_fraction_theta_full 0.995
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_diffrn_reflns_av_sigmaI/netI    0.0300
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_diffrn_reflns_limit_k_min       -10
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_exptl_crystal_colour            'pale rose'
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_exptl_crystal_density_method    'not measured'
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_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
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'calc w=1/[\s^2^(Fo^2^)+(0.0395P)^2^+0.2169P] where P=(Fo^2^+2Fc^2^)/3'
_refine_ls_weighting_scheme      calc
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_reflns_number_gt                3137
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_reflns_threshold_expression     >2sigma(I)
_cod_data_source_file            c4dt03379e2.cif
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_cod_depositor_comments
'Adding full bibliography for 7033896--7033902.cif.'
_cod_original_cell_volume        1074.22(15)
_cod_database_code               7033896