#------------------------------------------------------------------------------ #$Date: 2012-02-03 17:16:24 +0000 (Fri, 03 Feb 2012) $ #$Revision: 32112 $ #$URL: svn://www.crystallography.net/cod/cif/2/00/07/2000746.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_2000746 loop_ _publ_author_name 'Morosin, B.' 'Nigrey, P. J.' _publ_section_title ; Structure of bis(methylenedithio)tetrathiafulvalene dicyanoargentate(I) ; _journal_issue 7 _journal_name_full 'Acta Crystallographica Section C' _journal_page_first 1216 _journal_page_last 1218 _journal_volume 48 _journal_year 1992 _chemical_formula_moiety 'C8 H4 S8,C2 Ag1 N2' _chemical_formula_sum 'C10 H4 Ag N2 S8' _chemical_formula_weight 516.54 _symmetry_cell_setting orthorhombic _symmetry_space_group_name_Hall '-P 2n -2' _symmetry_space_group_name_H-M 'P m n n' _cell_angle_alpha 90 _cell_angle_beta 90 _cell_angle_gamma 90 _cell_formula_units_Z 2 _cell_length_a 8.794(3) _cell_length_b 20.333(7) _cell_length_c 4.247(2) _cell_volume 759.4(5) _diffrn_radiation_type Mo _diffrn_radiation_wavelength 0.71073 _exptl_absorpt_coefficient_mu 2.363 _exptl_crystal_density_diffrn 2.261 _exptl_crystal_F_000 506 _[local]_cod_data_source_file st0531.cif _[local]_cod_data_source_block st0531a _[local]_cod_chemical_formula_sum_orig 'C10 H4 Ag1 N2 S8' _cod_original_cell_volume 759.27 _cod_database_code 2000746 loop_ _atom_site_label _atom_site_fract_x _atom_site_fract_y _atom_site_fract_z _atom_site_U_iso_or_equiv Ag .0 .0 .0 .0449(2) S(1) .1672(6) .43394(3) .2908(2) .0292(2) S(2) .16898(7) .30612(3) -.0961(2) .0296(2) C(1) .0 .4712(2) .4082(10) .0260(10) C(2) .0769(3) .37010(11) .1005(7) .0240(10) C(3) .0 .2550(2) -.0771(13) .0340(10) C(4) .0 .0802(2) .3130(12) .0360(10) N .0 .1186(2) .4677(13) .057(2) H(1) .0 .225(2) -.260(10) .050(10) H(2) .0 .231(2) .130(10) .06(2)