#------------------------------------------------------------------------------ #$Date: 2011-09-10 04:16:28 +0100 (Sat, 10 Sep 2011) $ #$Revision: 25271 $ #$URL: svn://www.crystallography.net/cod/cif/2/2000225.cif $ #------------------------------------------------------------------------------ # # This file is available in the Crystallography Open Database (COD), # http://www.crystallography.net/. The original data for this entry # were provided by IUCr Journals, http://journals.iucr.org/. # # The file may be used within the scientific community so long as # proper attribution is given to the journal article from which the # data were obtained. # data_2000225 loop_ _publ_author_name 'Starynowicz, P.' _publ_section_title ; Structure of caesium dicyanamide ; _journal_issue 10 _journal_name_full 'Acta Crystallographica Section C' _journal_page_first 2198 _journal_page_last 2199 _journal_volume 47 _journal_year 1991 _chemical_formula_moiety 'Cs1,C2 N3' _chemical_formula_sum 'C2 Cs N3' _chemical_formula_weight 199.0 _symmetry_cell_setting monoclinic _symmetry_space_group_name_Hall '-C 2yc' _symmetry_space_group_name_H-M 'C 1 2/c 1' _cell_angle_alpha 90 _cell_angle_beta 110.94(4) _cell_angle_gamma 90 _cell_formula_units_Z 8 _cell_length_a 9.385(5) _cell_length_b 12.702(9) _cell_length_c 8.261(5) _cell_volume 919.7(10) _diffrn_radiation_type Mo _diffrn_radiation_wavelength 0.71069 _exptl_absorpt_coefficient_mu 8.0 _exptl_crystal_density_diffrn 2.873(3) _exptl_crystal_density_meas 2.86 _exptl_crystal_F_000 704 _[local]_cod_data_source_file mu0242.cif _[local]_cod_data_source_block mu0242a _[local]_cod_chemical_formula_sum_orig 'C2 Cs1 N3' _cod_original_cell_volume 920(2) _cod_database_code 2000225 loop_ _atom_site_label _atom_site_fract_x _atom_site_fract_y _atom_site_fract_z _atom_site_U_iso_or_equiv CS1 .0 -.01910(10) .25 .0660(3) CS2 .5 .12190(10) .25 .0668(3) N1 .0969(13) .1733(10) .0696(13) .084(3) N2 .2249(14) .3226(10) .2446(15) .090(3) N3 .1801(12) .4131(10) .4814(13) .082(3) C1 .1511(12) .2464(9) .1577(12) .063(3) C2 .1941(12) .3676(8) .3710(14) .065(3)