{(<i>E</i>)-4-Hydroxy-<i>N</i>'-[phenyl(pyridin-2-yl-κ<i>N</i>)methylidene]benzohydrazide-κ^2^<i>N</i>',<i>O</i>}bis(nitrato-κ^2^<i>O</i>,<i>O</i>')copper(II)
Bikas, Rahman; Sattari, Farhad; Notash, Behrouz; Acta Crystallographica Section E 68 (2012) m132–m133; doi:10.1107/S1600536811055772

data_2233504
_publ_section_title
;
 {(<i>E</i>)-4-Hydroxy-<i>N</i>'-[phenyl(pyridin-2-yl-\k<i>N</i>)methylidene]benzohydrazide-\k^2^<i>N</i>',<i>O</i>}bis(nitrato-\k^2^<i>O</i>,<i>O</i>')copper(II)
;
_journal_coeditor_code           HY2498
_journal_issue                   2
_journal_name_full               'Acta Crystallographica Section E'
_journal_page_first              m132
_journal_page_last               m133
_journal_paper_doi               10.1107/S1600536811055772
_journal_volume                  68
_journal_year                    2012
_chemical_formula_iupac          '[Cu (N O3)2 (C19 H15 N3 O2)]'
_chemical_formula_moiety         'C19 H15 Cu N5 O8'
_chemical_formula_sum            'C19 H15 Cu N5 O8'
_chemical_formula_weight         504.91
_chemical_name_systematic
;
{(<i>E</i>)-4-Hydroxy-<i>N</i>'-[phenyl(pyridin-2-yl-
\k<i>N</i>)methylidene]benzohydrazide-\k^2^<i>N</i>',<i>O</i>}bis(nitrato-
\k^2^<i>O</i>,<i>O</i>')copper(II)
;
_space_group_IT_number           2
_symmetry_cell_setting           triclinic
_symmetry_space_group_name_Hall  '-P 1'
_symmetry_space_group_name_H-M   'P -1'
_atom_sites_solution_hydrogens   geom
_atom_sites_solution_primary     direct
_atom_sites_solution_secondary   difmap
_audit_creation_method           SHELXL-97
_cell_angle_alpha                102.51(3)
_cell_angle_beta                 105.07(3)
_cell_angle_gamma                111.16(3)
_cell_formula_units_Z            2
_cell_length_a                   9.881(2)
_cell_length_b                   10.373(2)
_cell_length_c                   11.964(2)
_cell_measurement_reflns_used    5533
_cell_measurement_temperature    298(2)
_cell_measurement_theta_max      29.16
_cell_measurement_theta_min      1.88
_cell_volume                     1036.5(6)
_computing_cell_refinement       'X-AREA (Stoe & Cie, 2005)'
_computing_data_collection       'X-AREA (Stoe & Cie, 2005)'
_computing_data_reduction        'X-AREA (Stoe & Cie, 2005)'
_computing_molecular_graphics    'ORTEP-3 (Farrugia, 1997)'
_computing_publication_material  'WinGX (Farrugia, 1999)'
_computing_structure_refinement  'SHELXL97 (Sheldrick, 2008)'
_computing_structure_solution    'SHELXS97 (Sheldrick, 2008)'
_diffrn_ambient_temperature      298(2)
_diffrn_detector_area_resol_mean '0.15 mm'
_diffrn_measured_fraction_theta_full 0.988
_diffrn_measured_fraction_theta_max 0.988
_diffrn_measurement_device_type  'Stoe IPDS 2T'
_diffrn_measurement_method       'rotation method'
_diffrn_radiation_monochromator  graphite
_diffrn_radiation_source         'fine-focus sealed tube'
_diffrn_radiation_type           MoK\a
_diffrn_radiation_wavelength     0.71073
_diffrn_reflns_av_R_equivalents  0.0985
_diffrn_reflns_av_sigmaI/netI    0.0727
_diffrn_reflns_limit_h_max       13
_diffrn_reflns_limit_h_min       -13
_diffrn_reflns_limit_k_max       14
_diffrn_reflns_limit_k_min       -13
_diffrn_reflns_limit_l_max       16
_diffrn_reflns_limit_l_min       -16
_diffrn_reflns_number            11512
_diffrn_reflns_theta_full        29.16
_diffrn_reflns_theta_max         29.16
_diffrn_reflns_theta_min         1.88
_exptl_absorpt_coefficient_mu    1.113
_exptl_absorpt_correction_T_max  0.8969
_exptl_absorpt_correction_T_min  0.7313
_exptl_absorpt_correction_type   numerical
_exptl_absorpt_process_details   '(X-SHAPE and X-RED32; Stoe & Cie, 2005)'
_exptl_crystal_colour            green
_exptl_crystal_density_diffrn    1.618
_exptl_crystal_density_method    'not measured'
_exptl_crystal_description       needle
_exptl_crystal_F_000             514
_exptl_crystal_size_max          0.30
_exptl_crystal_size_mid          0.15
_exptl_crystal_size_min          0.10
_refine_diff_density_max         0.835
_refine_diff_density_min         -0.643
_refine_ls_extinction_method     none
_refine_ls_goodness_of_fit_ref   1.127
_refine_ls_hydrogen_treatment    mixed
_refine_ls_matrix_type           full
_refine_ls_number_parameters     303
_refine_ls_number_reflns         5533
_refine_ls_number_restraints     1
_refine_ls_restrained_S_all      1.128
_refine_ls_R_factor_all          0.0763
_refine_ls_R_factor_gt           0.0515
_refine_ls_shift/su_max          0.000
_refine_ls_shift/su_mean         0.000
_refine_ls_structure_factor_coef Fsqd
_refine_ls_weighting_details
'calc w=1/[\s^2^(Fo^2^)+(0.1213P)^2^] where P=(Fo^2^+2Fc^2^)/3'
_refine_ls_weighting_scheme      calc
_refine_ls_wR_factor_gt          0.1524
_refine_ls_wR_factor_ref         0.1974
_reflns_number_gt                4123
_reflns_number_total             5533
_reflns_threshold_expression     I>2\s(I)
_cod_data_source_file            hy2498.cif
_cod_data_source_block           I
_cod_original_cell_volume        1036.6(6)
_cod_database_code               2233504
_cod_database_fobs_code          2233504