#------------------------------------------------------------------------------ #$Date: 2008-11-20 21:58:43 +0200 (Thu, 20 Nov 2008) $ #$Revision: 481 $ #$URL: file:///home/coder/svn-repositories/cod/cif/2/2000781.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_2000781 _journal_name_full 'Acta Crystallographica Section C' _journal_year 1992 _journal_volume 48 _journal_page_first 1307 _journal_page_last 1308 loop_ _publ_author_name 'Jones, P.G.' _chemical_formula_sum 'C2 H3 Cl1 Cu1 N1' _chemical_formula_weight 140.0 _symmetry_cell_setting orthorhombic _symmetry_space_group_name_H-M 'P n m a' _symmetry_space_group_name_Hall '-P 2ac 2n' _cell_length_a 8.545(3) _cell_length_b 3.8691(10) _cell_length_c 12.692(4) _cell_angle_alpha 90. _cell_angle_beta 90. _cell_angle_gamma 90. _cell_volume 419.6(3) _cell_formula_units_Z 4 _exptl_crystal_density_diffrn 2.217 _exptl_crystal_density_meas ? _exptl_crystal_F_000 272 _exptl_absorpt_coefficient_mu 5.6 _diffrn_radiation_type Mo _diffrn_radiation_wavelength 0.71069 loop_ _atom_site_label _atom_site_fract_x _atom_site_fract_y _atom_site_fract_z _atom_site_U_iso_or_equiv Cu .89052(4) .2500 .44202(3) .0317(2) Cl .97440(8) .2500 .62297(5) .0225(2) N .6696(3) .2500 .4085(2) .0294(7) C(1) .3795(3) .2500 .3504(2) .0270(8) C(2) .5421(4) .2500 .3825(2) .0235(8) H(1) .3618 .0991 .3026 ? H(2) .2981 .2500 .4008 ?