#------------------------------------------------------------------------------ #$Date: 2016-02-14 14:26:36 +0000 (Sun, 14 Feb 2016) $ #$Revision: 176435 $ #$URL: svn://www.crystallography.net/cod/cif/2/00/06/2000697.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_2000697 loop_ _publ_author_name 'Kane, C. J.' 'Long, R.' 'Pettit, W. E.' 'Breneman, G. L.' 'Pettit, G. R.' _publ_section_title ; Structure of bis(2-chloroethyl)ammonium hexachlorostannate ; _journal_issue 8 _journal_name_full 'Acta Crystallographica Section C' _journal_page_first 1490 _journal_page_last 1491 _journal_paper_doi 10.1107/S0108270191015135 _journal_volume 48 _journal_year 1992 _chemical_formula_moiety 'C8 H20 Cl10 N2 Sn1' _chemical_formula_sum 'C8 H20 Cl10 N2 Sn' _chemical_formula_weight 617.48 _symmetry_cell_setting monoclinic _symmetry_space_group_name_H-M 'C 1 2/c 1' _cell_angle_alpha 90 _cell_angle_beta 127.9(2) _cell_angle_gamma 90 _cell_formula_units_Z 4 _cell_length_a 15.67(2) _cell_length_b 13.54(2) _cell_length_c 13.24(2) _cell_volume 2217(8) _diffrn_radiation_type Mo _diffrn_radiation_wavelength 0.71073 _exptl_absorpt_coefficient_mu 2.370 _exptl_crystal_density_diffrn 1.85 _exptl_crystal_F_000 1208 _cod_data_source_file hh0578.cif _cod_data_source_block hh0578a _cod_original_cell_volume 2217 _cod_original_sg_symbol_H-M 'C 2/c' _cod_original_formula_sum 'C8 H20 Cl10 N2 Sn1' _cod_database_code 2000697 loop_ _atom_site_label _atom_site_fract_x _atom_site_fract_y _atom_site_fract_z Sn .000 .08420(10) .250 Cl(1) .1881(2) .0848(3) .3273(2) Cl(2) .0446(2) .2148(3) .4040(3) Cl(3) .0478(2) -.0419(3) .4082(3) Cl(4) .0901(2) .5303(3) .1992(4) Cl(5) .1423(3) .3324(4) .0044(3) N .2852(6) .3819(9) .2967(9) C(2) .2030(8) .3610(10) .3180(10) C(3) .3150(9) .2940(10) .2550(10) C(4) .1660(9) .4540(10) .3410(10) C(5) .2174(9) .2450(10) .1310(10) H(1) .3483 .4097 .3719 H(2) .2545 .4318 .2293 H(3) .2340 .3179 .3916 H(4) .1407 .3270 .2460 H(5) .3500 .2458 .3227 H(6) .3663 .3127 .2406 H(7) .1245 .4407 .3676 H(8) .2302 .4902 .4068 H(9) .2430 .1923 .1059 H(10) .1723 .2152 .1485 loop_ _geom_bond_atom_site_label_1 _geom_bond_atom_site_label_2 _geom_bond_distance Sn Cl(1) 2.455(3) Sn Cl(2) 2.455(4) Sn Cl(3) 2.436(4) Cl(4) C(4) 1.800(10) Cl(5) C(5) 1.780(10) N C(2) 1.51(2) N C(3) 1.50(2) C(2) C(4) 1.50(2) C(3) C(5) 1.54(2)