Mn2Fe(CO)14 Agron P, Ellison R, Levy H Acta Crystallographica 23 (1967) 1079-1086 The crystal structure of dimanganese iron carbonyl, Mn2Fe(CO)14 _cod_database_code 1008061 _database_code_amcsd 0016003 CELL PARAMETERS: 11.9350 14.2870 11.7320 90.000 97.230 90.000 SPACE GROUP: C2/m X-RAY WAVELENGTH: 1.541838 Cell Volume: 1984.580 Density (g/cm3): 1.867 MAX. ABS. INTENSITY / VOLUME**2: 7.649103440 RIR: 1.334 RIR based on corundum from Acta Crystallographica A38 (1982) 733-739 2-THETA INTENSITY D-SPACING H K L Multiplicity 7.60 1.56 11.6387 0 0 1 2 9.70 2.75 9.1164 1 1 0 4 11.74 48.65 7.5403 -1 1 1 4 12.39 25.88 7.1435 0 2 0 2 12.90 100.00 6.8614 1 1 1 4 14.55 71.92 6.0882 0 2 1 4 14.96 7.98 5.9201 2 0 0 2 15.23 47.24 5.8194 0 0 2 2 15.92 35.24 5.5674 -2 0 1 2 17.27 5.51 5.1361 -1 1 2 4 17.64 13.55 5.0272 2 0 1 2 18.87 3.86 4.7028 1 1 2 4 19.47 4.29 4.5582 2 2 0 4 19.68 2.35 4.5118 0 2 2 4 20.00 2.96 4.4387 -2 0 2 2 20.10 2.39 4.4183 1 3 0 4 22.74 5.30 3.9113 2 0 2 2 22.92 1.21 3.8796 0 0 3 2 24.93 9.99 3.5717 0 4 0 2 25.81 6.01 3.4513 1 1 3 4 25.82 3.19 3.4500 -2 0 3 2 25.97 1.27 3.4307 2 2 2 4 26.39 1.21 3.3774 -3 1 2 4 29.06 1.53 3.0724 2 0 3 2 29.20 4.77 3.0582 2 4 0 4 29.34 4.31 3.0441 0 4 2 4 29.57 1.02 3.0208 3 1 2 4 29.66 10.04 3.0125 -3 3 1 4 29.72 3.44 3.0063 -2 4 1 4 29.93 26.01 2.9856 -1 3 3 4 30.19 13.88 2.9600 4 0 0 2 30.20 7.13 2.9590 -4 0 1 2 30.71 2.00 2.9117 2 4 1 4 30.73 4.99 2.9097 0 0 4 2 30.86 3.95 2.8976 -3 1 3 4 31.13 19.64 2.8730 3 3 1 4 31.35 1.11 2.8532 -1 1 4 4 31.39 37.07 2.8496 1 3 3 4 31.70 2.33 2.8225 2 2 3 4 31.87 3.24 2.8076 -3 3 2 4 32.13 4.75 2.7862 4 0 1 2 32.16 35.97 2.7837 -4 0 2 2 32.17 1.11 2.7827 -2 4 2 4 32.23 13.44 2.7777 1 5 0 4 32.54 14.64 2.7520 -2 0 4 2 32.76 2.74 2.7338 -4 2 1 4 32.93 16.92 2.7200 -1 5 1 4 33.22 1.94 2.6972 1 1 4 4 33.38 14.35 2.6839 1 5 1 4 34.55 3.77 2.5957 4 2 1 4 34.58 10.62 2.5937 -4 2 2 4 34.60 1.67 2.5926 3 3 2 4 34.94 4.85 2.5680 -2 2 4 4 34.98 2.97 2.5651 3 1 3 4 35.39 3.08 2.5360 -1 5 2 4 35.72 9.15 2.5136 4 0 2 2 35.72 1.14 2.5134 -3 3 3 4 36.07 8.96 2.4902 2 0 4 2 37.78 20.36 2.3812 0 6 0 2 37.81 1.15 2.3793 1 3 4 4 38.35 5.43 2.3474 -5 1 1 4 39.00 1.59 2.3097 -1 1 5 4 39.12 2.65 2.3028 -3 5 1 4 39.79 1.77 2.2656 -2 0 5 2 40.29 2.31 2.2386 3 5 1 4 40.31 2.70 2.2375 5 1 1 4 40.50 9.93 2.2276 1 5 3 4 40.65 1.17 2.2194 -4 0 4 2 40.81 4.06 2.2114 -3 3 4 4 40.93 4.17 2.2048 1 1 5 4 40.95 1.42 2.2038 0 6 2 4 41.11 2.81 2.1956 -4 4 2 4 42.63 1.92 2.1211 -5 1 3 4 42.64 1.49 2.1204 5 3 0 4 43.02 2.18 2.1023 -3 1 5 4 43.11 3.40 2.0981 3 5 2 4 44.05 3.49 2.0555 -3 5 3 4 44.28 1.93 2.0458 5 3 1 4 44.34 2.05 2.0427 2 4 4 4 44.42 4.07 2.0395 -1 5 4 4 46.81 1.59 1.9409 -3 3 5 4 47.25 2.91 1.9237 5 3 2 4 47.45 4.41 1.9161 -2 0 6 2 47.70 1.37 1.9064 6 0 1 2 47.88 1.29 1.8998 5 1 3 4 48.28 1.84 1.8851 -4 4 4 4 49.09 3.55 1.8558 -6 0 3 2 49.10 1.43 1.8554 4 6 0 4 49.87 1.64 1.8286 -5 5 1 4 50.43 4.50 1.8095 -4 6 2 4 50.68 3.33 1.8012 6 0 2 2 50.70 1.25 1.8007 -2 6 4 4 51.38 5.40 1.7783 2 0 6 2 51.48 7.56 1.7752 5 5 1 4 51.63 1.26 1.7702 1 7 3 4 51.79 3.24 1.7652 0 8 1 4 52.00 5.18 1.7587 1 5 5 4 52.29 1.70 1.7495 3 5 4 4 53.09 1.24 1.7250 -4 0 6 2 53.22 3.05 1.7210 2 6 4 4 53.41 2.83 1.7154 -5 5 3 4 53.53 1.08 1.7120 -3 3 6 4 53.75 6.18 1.7054 -3 5 5 4 56.14 1.21 1.6382 1 7 4 4 57.29 1.11 1.6082 6 4 2 4 57.76 1.99 1.5962 -3 1 7 4 57.85 1.39 1.5939 7 3 0 4 57.93 1.12 1.5919 2 4 6 4 57.93 2.29 1.5918 5 5 3 4 59.41 1.20 1.5557 1 9 1 4 59.85 2.26 1.5453 6 0 4 2 60.24 1.10 1.5362 4 0 6 2 61.16 1.13 1.5154 2 2 7 4 61.69 1.03 1.5035 4 8 1 4 61.71 1.79 1.5031 -4 8 2 4 62.19 1.70 1.4928 -2 6 6 4 62.78 1.18 1.4800 8 0 0 2 62.80 1.21 1.4796 -6 0 6 2 62.81 2.23 1.4795 -8 0 2 2 63.94 1.80 1.4559 -2 0 8 2 64.00 1.08 1.4548 0 0 8 2 64.19 1.08 1.4509 -7 1 5 4 64.26 2.63 1.4496 1 9 3 4 64.91 1.53 1.4365 6 6 2 4 65.31 2.85 1.4287 0 10 0 2 65.51 2.27 1.4248 2 6 6 4 66.07 1.52 1.4141 -7 5 3 4 66.81 3.24 1.4002 -3 5 7 4 67.27 2.09 1.3919 -8 0 4 2 67.51 1.40 1.3875 0 10 2 4 68.07 1.33 1.3774 7 5 2 4 68.30 1.21 1.3733 2 0 8 2 72.50 1.06 1.3038 6 0 6 2 72.81 1.43 1.2990 -7 5 5 4 72.99 1.39 1.2963 6 6 4 4 74.68 1.49 1.2711 -4 10 2 4 79.72 1.12 1.2028 -9 5 1 4 83.37 1.21 1.1592 -7 5 7 4 ================================================================================ XPOW Copyright 1993 Bob Downs, Ranjini Swaminathan and Kurt Bartelmehs For reference, see Downs et al. (1993) American Mineralogist 78, 1104-1107.