C12H28N(RuCl4(C7H5N)2) Duff C M, Heath G A, Willis A C Acta Crystallographica C46 (1990) 2320-2324 Structural characterization of the RuIII benzonitrile complexes (Bu4N)[RuCl4(C6H5CN)2] and [RuCl3(C6H5CN)3] _database_code_amcsd 0010228 15.627 13.936 17.319 90 113.66 90 P2_1/c atom x y z occ Uiso Cl11 .04464 -.03272 -.11207 .0481 Cl12 -.05185 .15241 -.05751 .0674 N1 .1283 .0562 .0655 .0686 C11 .1995 .0892 .0978 .057 C12 .2914 .1320 .1353 .054 C13 .3102 .2151 .1024 .049 C14 .3981 .2532 .1348 .071 C15 .4678 .2076 .1987 .086 C16 .4501 .1256 .2331 .087 C17 .3617 .0866 .2022 .075 Ru2 .5 0 .5 .055 C121 .38245 -.01149 .55205 .0386 C122 .59540 .07709 .62638 .0536 N2 .4521 .1297 .4525 .0537 C21 .4285 .2054 .4299 .047 C22A .4078 .3033 .4065 .614 .050 C23A .4322 .3743 .4664 .614 .054 C24A .4169 .4687 .4423 .614 .091 C25A .3772 .4922 .3583 .614 .113 C26A .3528 .4212 .2984 .614 .100 C27A .3681 .3268 .3225 .614 .098 C22B .3948 .3021 .3955 .386 .068 C23B .3449 .3549 .4300 .386 .054 C24B .3154 .4457 .4008 .386 .091 C25B .3359 .4837 .3371 .386 .113 C26B .3858 .4309 .3026 .386 .100 C27B .4153 .3401 .3318 .386 .098 N3 .8658 .1797 .6529 .068 C31 .8608 .0830 .6925 .045 C32 .8528 -.0035 .6386 .055 C33 .8340 -.0935 .6800 .065 C34 .8234 -.1800 .6258 .090 C41 .7727 .1964 .5795 .105 C42 .7616 .2913 .5346 .046 C43 .6635 .2984 .4659 .053 C44 .6539 .3803 .4063 .065 C51 .8861 .2575 .7192 .094 C52 .8107 .2752 .7514 .052 C53 .8385 .3591 .8127 .058 C54 .7722 .3721 .8561 .071 C61 .9419 .1815 .6195 .096 C62 .0386 .1537 .6808 .056 C63 .1084 .1671 .6418 .075 C64 .0930 .1102 .5670 .087