#------------------------------------------------------------------------------ #$Date: 2011-09-28 15:24:46 +0100 (Wed, 28 Sep 2011) $ #$Revision: 26848 $ #$URL: svn://www.crystallography.net/cod/cif/2/00/04/2000463.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_2000463 loop_ _publ_author_name 'Byers, J. J.' 'Pennington, W. T.' 'Robinson, G. H.' _publ_section_title ; Bis-adducts of trimethylaluminium and trimethylgallium with N,N,N',N'-tetramethylethylenediamine ; _journal_issue 11 _journal_name_full 'Acta Crystallographica Section C' _journal_page_first 2023 _journal_page_last 2025 _journal_volume 48 _journal_year 1992 _chemical_formula_sum 'C12 H34 Al2 N2' _chemical_formula_weight 260.38 _symmetry_cell_setting monoclinic _symmetry_space_group_name_Hall '-P 2yn' _symmetry_space_group_name_H-M 'P 1 21/n 1' _cell_angle_alpha 90 _cell_angle_beta 110.32(2) _cell_angle_gamma 90 _cell_formula_units_Z 2 _cell_length_a 10.719(3) _cell_length_b 7.648(2) _cell_length_c 12.224(3) _cell_volume 939.7(5) _diffrn_radiation_type Mo _diffrn_radiation_wavelength 0.71073 _exptl_absorpt_coefficient_mu 0.20 _exptl_crystal_density_diffrn 0.92 _exptl_crystal_F_000 292 _[local]_cod_data_source_file st0555.cif _[local]_cod_data_source_block st0555a loop_ _atom_site_label _atom_site_fract_x _atom_site_fract_y _atom_site_fract_z _atom_site_U_iso_or_equiv Al(1) .75410(10) .19460(10) .02810(10) .0540(10) N(1) .8365(2) .4393(3) .0253(2) .0500(10) C(1) .7356(4) .0940(5) -.1260(3) .094(2) C(2) .8862(4) .0729(5) .1591(4) .097(2) C(3) .5847(3) .2422(5) .0495(3) .080(2) C(4) .9638(3) .4149(3) .0027(3) .0560(10) C(5) .7400(3) .5450(5) -.0679(3) .086(2) C(6) .8600(4) .5236(5) .1399(3) .084(2) H(1A) .8225 .0824 -.1314 ? H(1B) .6698 .0037 -.1393 ? H(1C) .6930 .1843 -.1808 ? H(2A) .8469 -.0341 .1725 ? H(2B) .9112 .1447 .2278 ? H(2C) .9644 .0484 .1405 ? H(3A) .5271 .3061 -.0163 ? H(3B) .5923 .3018 .1206 ? H(3C) .5418 .1456 .0721 ? H(4A) .9379 .3450 -.0669 ? H(4B) 1.0204 .3432 .0645 ? H(5A) .6513 .5461 -.0659 ? H(5B) .7718 .6622 -.0687 ? H(5C) .7530 .4964 -.1355 ? H(6C) .9228 .4541 .1991 ? H(6A) .8940 .6403 .1429 ? H(6B) .7757 .5204 .1511 ? loop_ _geom_bond_atom_site_label_1 _geom_bond_atom_site_label_2 _geom_bond_distance Al(1) N(1) 2.074(2) Al(1) C(1) 1.980(4) Al(1) C(2) 1.964(4) Al(1) C(3) 1.957(4) N(1) C(4) 1.495(4) N(1) C(5) 1.484(4) N(1) C(6) 1.481(4) C(4) C(4a) 1.529(6) _cod_database_code 2000463