#------------------------------------------------------------------------------ #$Date: 2008-01-14 00:15:36 +0200 (Mon, 14 Jan 2008) $ #$Revision: 14 $ #$URL: file:///home/coder/svn-repositories/cod/cif/1/1010308.cif $ #------------------------------------------------------------------------------ # # This file is available in the Crystallography Open Database (COD), # http://www.crystallography.net/ # # All data on this site have been placed in the public domain by the # contributors. # data_1010308 _chemical_name_systematic 'Silver azide' _chemical_formula_structural 'Ag N3' _chemical_formula_sum 'Ag N3' _publ_section_title ; Structure cristalline de l'azoture d'argent. ; _publ_author_name 'Bassiere, M' _journal_name_full ; Comptes Rendus Hebdomadaires des Seances de l'Academie des Sciences (1884 - 1965) ; _journal_coden_ASTM COREAF _journal_volume 201 _journal_year 1935 _journal_page_first 735 _journal_page_last 737 _cell_length_a 5.58(3) _cell_length_b 5.93(3) _cell_length_c 6.04(3) _cell_angle_alpha 90 _cell_angle_beta 90 _cell_angle_gamma 90 _cell_volume 199.9 _cell_formula_units_Z 4 _exptl_crystal_density_meas 4.81(5) _symmetry_space_group_name_H-M 'I b a m' _symmetry_Int_Tables_number 72 _symmetry_cell_setting orthorhombic loop_ _symmetry_equiv_pos_as_xyz 'x,y,z' '-x,-y,z' '-x,y,1/2-z' 'x,-y,1/2-z' '-x,-y,-z' 'x,y,-z' 'x,-y,1/2+z' '-x,y,1/2+z' '1/2+x,1/2+y,1/2+z' '1/2-x,1/2-y,1/2+z' '1/2-x,1/2+y,-z' '1/2+x,1/2-y,-z' '1/2-x,1/2-y,1/2-z' '1/2+x,1/2+y,1/2-z' '1/2+x,1/2-y,z' '1/2-x,1/2+y,z' loop_ _atom_type_symbol _atom_type_oxidation_number Ag1+ 1.000 N0- -0.333 loop_ _atom_site_label _atom_site_type_symbol _atom_site_symmetry_multiplicity _atom_site_Wyckoff_symbol _atom_site_fract_x _atom_site_fract_y _atom_site_fract_z _atom_site_occupancy _atom_site_attached_hydrogens _atom_site_calc_flag Ag1 Ag1+ 4 b 0.5 0. 0.25 1. 0 d N1 N0- 4 c 0. 0. 0. 1. 0 d N2 N0- 8 j 0.145(5) 0.145(5) 0. 1. 0 d