data_2200157 _journal_name_full 'Acta Crystallographica, Section E' _journal_year 2001 _journal_volume 57 _journal_page_first o271 _journal_page_last o272 _publ_section_title ; (E)-1-Diphenylsilyl-2-triphenylsilylethene ; loop_ _publ_author_name 'Lee, Suk Joong' 'Han, Byung Hee' 'Sung, Chang-Keun' 'Kim, Jin-Gyu' 'Suh, Il-Hwan' _chemical_formula_moiety 'C32 H28 Si2' _chemical_formula_sum 'C32 H28 Si2' _chemical_formula_iupac 'C32 H28 Si2' _chemical_formula_weight 468.72 _symmetry_cell_setting triclinic _symmetry_space_group_name_H-M 'P -1' loop_ _symmetry_equiv_pos_as_xyz 'x, y, z' '-x, -y, -z' _cell_length_a 11.1046(12) _cell_length_b 11.4205(11) _cell_length_c 12.7004(9) _cell_angle_alpha 72.632(7) _cell_angle_beta 78.905(7) _cell_angle_gamma 62.198(11) _cell_volume 1357.1(2) _cell_formula_units_Z 2 _cell_measurement_temperature 293(2) _exptl_crystal_density_diffrn 1.147 _diffrn_ambient_temperature 293(2) loop_ _atom_site_label _atom_site_fract_x _atom_site_fract_y _atom_site_fract_z _atom_site_U_iso_or_equiv _atom_site_adp_type _atom_site_calc_flag _atom_site_refinement_flags _atom_site_occupancy _atom_site_disorder_assembly _atom_site_disorder_group _atom_site_type_symbol Si1 .34449(10) .32786(10) .55899(8) .0513(3) Uani d . 1 . . Si Si2 .34458(12) .46792(12) .17876(8) .0666(4) Uani d . 1 . . Si H1 .424(3) .530(3) .169(2) .048(8) Uiso d . 1 . . H C1 .5137(3) .2244(3) .6203(3) .0495(8) Uani d . 1 . . C C2 .6126(4) .2719(4) .5972(3) .0689(11) Uani d . 1 . . C H2 .5945 .3565 .5485 .083 Uiso calc R 1 . . H C3 .7365(4) .1984(5) .6438(4) .0867(14) Uani d . 1 . . C H3 .8001 .2338 .6274 .104 Uiso calc R 1 . . H C4 .7661(4) .0731(5) .7144(4) .0809(12) Uani d . 1 . . C H4 .8495 .0235 .7467 .097 Uiso calc R 1 . . H C5 .6733(4) .0208(4) .7375(3) .0745(11) Uani d . 1 . . C H5 .6940 -.0652 .7844 .089 Uiso calc R 1 . . H C6 .5485(4) .0954(4) .6912(3) .0592(10) Uani d . 1 . . C H6 .4860 .0587 .7077 .071 Uiso calc R 1 . . H C7 .2424(3) .4776(3) .6223(3) .0501(9) Uani d . 1 . . C C8 .2855(4) .4962(4) .7088(3) .0683(11) Uani d . 1 . . C H8 .3701 .4341 .7362 .082 Uiso calc R 1 . . H C9 .2038(5) .6067(4) .7549(4) .0915(14) Uani d . 1 . . C H9 .2338 .6167 .8138 .110 Uiso calc R 1 . . H C10 .0804(5) .7005(4) .7152(4) .0914(14) Uani d . 1 . . C H10 .0264 .7741 .7468 .110 Uiso calc R 1 . . H C11 .0366(4) .6858(4) .6290(4) .0853(13) Uani d . 1 . . C H11 -.0477 .7495 .6016 .102 Uiso calc R 1 . . H C12 .1167(4) .5768(4) .5822(3) .0716(11) Uani d . 1 . . C H12 .0863 .5693 .5223 .086 Uiso calc R 1 . . H C13 .2532(3) .2185(3) .5873(3) .0481(8) Uani d . 1 . . C C14 .1422(3) .2334(4) .6644(3) .0574(9) Uani d . 1 . . C H14 .1072 .3051 .6990 .069 Uiso calc R 1 . . H C15 .0833(4) .1449(4) .6908(3) .0695(11) Uani d . 1 . . C H15 .0096 .1568 .7427 .083 Uiso calc R 1 . . H C16 .1333(4) .0394(4) .6405(4) .0750(12) Uani d . 1 . . C H16 .0936 -.0205 .6583 .090 Uiso calc R 1 . . H C17 .2423(4) .0215(4) .5635(3) .0717(11) Uani d . 1 . . C H17 .2767 -.0505 .5294 .086 Uiso calc R 1 . . H C18 .2994(3) .1108(4) .5378(3) .0605(10) Uani d . 1 . . C H18 .3722 .0987 .4849 .073 Uiso calc R 1 . . H C19 .3716(5) .3919(4) .4085(3) .0660(11) Uani d . 1 . . C H19 .435(4) .420(4) .379(3) .109(17) Uiso d . 1 . . H C20 .3069(5) .4040(4) .3286(3) .0728(12) Uani d . 1 . . C H20 .238(4) .370(4) .349(3) .102(15) Uiso d . 1 . . H C21 .1857(4) .5924(4) .1083(3) .0661(11) Uani d . 1 . . C C22 .0754(5) .5628(5) .1157(4) .0861(13) Uani d . 1 . . C H22 .0801 .4790 .1580 .103 Uiso calc R 1 . . H C23 -.0397(6) .6562(8) .0614(5) .121(2) Uani d . 1 . . C H23 -.1124 .6351 .0667 .145 Uiso calc R 1 . . H C24 -.0486(7) .7795(8) -.0003(6) .144(3) Uani d . 1 . . C H24 -.1277 .8429 -.0360 .173 Uiso calc R 1 . . H C25 .0576(8) .8102(6) -.0096(5) .136(3) Uani d . 1 . . C H25 .0521 .8938 -.0534 .163 Uiso calc R 1 . . H C26 .1732(6) .7190(5) .0449(4) .0930(14) Uani d . 1 . . C H26 .2443 .7425 .0393 .112 Uiso calc R 1 . . H C27 .4393(4) .3197(4) .1137(3) .0611(10) Uani d . 1 . . C C28 .4030(4) .3177(4) .0162(3) .0736(11) Uani d . 1 . . C H28 .3285 .3924 -.0185 .088 Uiso calc R 1 . . H C29 .4750(5) .2072(5) -.0307(4) .0927(14) Uani d . 1 . . C H29 .4485 .2082 -.0962 .111 Uiso calc R 1 . . H C30 .5847(5) .0969(5) .0189(4) .0898(14) Uani d . 1 . . C H30 .6332 .0228 -.0129 .108 Uiso calc R 1 . . H C31 .6233(4) .0952(5) .1147(4) .0866(14) Uani d . 1 . . C H31 .6983 .0200 .1484 .104 Uiso calc R 1 . . H C32 .5513(4) .2048(5) .1619(3) .0805(12) Uani d . 1 . . C H32 .5783 .2019 .2279 .097 Uiso calc R 1 . . H loop_ _atom_site_aniso_label _atom_site_aniso_U_11 _atom_site_aniso_U_22 _atom_site_aniso_U_33 _atom_site_aniso_U_12 _atom_site_aniso_U_13 _atom_site_aniso_U_23 Si1 .0526(6) .0554(6) .0465(6) -.0226(5) -.0048(5) -.0136(5) Si2 .0840(8) .0771(8) .0468(6) -.0442(7) -.0050(6) -.0104(6) C1 .046(2) .051(2) .054(2) -.0201(18) .0009(17) -.0212(18) C2 .059(3) .054(2) .091(3) -.025(2) -.014(2) -.007(2) C3 .055(3) .079(3) .128(4) -.033(2) -.021(3) -.013(3) C4 .049(2) .083(3) .101(3) -.016(2) -.022(2) -.019(3) C5 .064(3) .067(3) .077(3) -.019(2) -.017(2) -.005(2) C6 .057(2) .065(3) .059(2) -.032(2) .0011(19) -.014(2) C7 .058(2) .044(2) .044(2) -.0206(18) -.0060(17) -.0064(16) C8 .074(3) .057(2) .067(3) -.015(2) -.020(2) -.017(2) C9 .120(4) .070(3) .083(3) -.026(3) -.016(3) -.037(3) C10 .098(4) .044(3) .104(4) -.007(3) .001(3) -.024(3) C11 .064(3) .058(3) .100(4) -.004(2) -.009(3) -.009(3) C12 .071(3) .065(3) .068(3) -.019(2) -.017(2) -.011(2) C13 .044(2) .050(2) .046(2) -.0142(17) -.0080(16) -.0138(17) C14 .053(2) .061(2) .059(2) -.021(2) -.0054(19) -.0210(19) C15 .054(2) .083(3) .076(3) -.034(2) .004(2) -.023(2) C16 .076(3) .073(3) .093(3) -.047(3) -.011(3) -.016(3) C17 .070(3) .064(3) .087(3) -.025(2) -.009(2) -.032(2) C18 .047(2) .061(2) .070(3) -.019(2) .0002(19) -.021(2) C19 .075(3) .074(3) .056(3) -.037(3) -.006(2) -.016(2) C20 .079(3) .091(3) .055(3) -.044(3) -.001(2) -.017(2) C21 .086(3) .064(3) .044(2) -.030(2) .006(2) -.017(2) C22 .082(3) .094(3) .075(3) -.036(3) -.002(3) -.017(3) C23 .080(4) .165(6) .097(4) -.024(4) -.002(3) -.054(4) C24 .108(5) .139(7) .091(5) .039(5) -.020(5) -.045(5) C25 .181(7) .070(4) .089(4) -.001(5) -.016(5) -.014(3) C26 .132(4) .070(3) .070(3) -.040(3) -.006(3) -.013(3) C27 .066(3) .069(3) .043(2) -.034(2) -.0005(19) -.0018(19) C28 .080(3) .067(3) .061(3) -.020(2) -.015(2) -.011(2) C29 .113(4) .076(3) .077(3) -.021(3) -.017(3) -.028(3) C30 .087(4) .065(3) .097(4) -.021(3) .006(3) -.020(3) C31 .065(3) .075(3) .088(4) -.017(3) -.011(3) .005(3) C32 .077(3) .089(3) .064(3) -.033(3) -.017(2) -.001(3) loop_ _geom_bond_atom_site_label_1 _geom_bond_atom_site_label_2 _geom_bond_site_symmetry_2 _geom_bond_distance _geom_bond_publ_flag Si1 C19 . 1.852(4) y Si1 C1 . 1.864(3) y Si1 C13 . 1.868(3) y Si1 C7 . 1.875(3) y Si2 C21 . 1.855(4) y Si2 C20 . 1.865(4) y Si2 C27 . 1.869(4) y Si2 H1 . 1.35(3) y C1 C2 . 1.388(4) ? C1 C6 . 1.393(4) ? C2 C3 . 1.374(5) ? C2 H2 . .9300 ? C3 C4 . 1.367(5) ? C3 H3 . .9300 ? C4 C5 . 1.364(5) ? C4 H4 . .9300 ? C5 C6 . 1.380(5) ? C5 H5 . .9300 ? C6 H6 . .9300 ? C7 C8 . 1.384(4) ? C7 C12 . 1.395(5) ? C8 C9 . 1.388(5) ? C8 H8 . .9300 ? C9 C10 . 1.361(6) ? C9 H9 . .9300 ? C10 C11 . 1.362(6) ? C10 H10 . .9300 ? C11 C12 . 1.378(5) ? C11 H11 . .9300 ? C12 H12 . .9300 ? C13 C18 . 1.386(4) ? C13 C14 . 1.395(4) ? C14 C15 . 1.376(4) ? C14 H14 . .9300 ? C15 C16 . 1.365(5) ? C15 H15 . .9300 ? C16 C17 . 1.376(5) ? C16 H16 . .9300 ? C17 C18 . 1.370(5) ? C17 H17 . .9300 ? C18 H18 . .9300 ? C19 C20 . 1.292(5) y C19 H19 . .89(4) ? C20 H20 . .97(4) ? C21 C26 . 1.386(5) ? C21 C22 . 1.395(5) ? C22 C23 . 1.370(6) ? C22 H22 . .9300 ? C23 C24 . 1.359(8) ? C23 H23 . .9300 ? C24 C25 . 1.355(8) ? C24 H24 . .9300 ? C25 C26 . 1.370(7) ? C25 H25 . .9300 ? C26 H26 . .9300 ? C27 C28 . 1.383(5) ? C27 C32 . 1.391(5) ? C28 C29 . 1.382(5) ? C28 H28 . .9300 ? C29 C30 . 1.363(6) ? C29 H29 . .9300 ? C30 C31 . 1.358(6) ? C30 H30 . .9300 ? C31 C32 . 1.377(6) ? C31 H31 . .9300 ? C32 H32 . .9300 ?