Fe2C9O9 Powell H, Ewens R Journal of the Chemical Society 1939 (1939) 286-292 The crystal structure of iron enneacarbonyl _cod_database_code 1010480 _database_code_amcsd 0017396 CELL PARAMETERS: 6.4500 6.4500 15.9800 90.000 90.000 120.000 SPACE GROUP: P6_3/m X-RAY WAVELENGTH: 1.541838 Cell Volume: 575.741 Density (g/cm3): 2.098 MAX. ABS. INTENSITY / VOLUME**2: 23.53214451 RIR: 3.652 RIR based on corundum from Acta Crystallographica A38 (1982) 733-739 2-THETA INTENSITY D-SPACING H K L Multiplicity 11.07 22.88 7.9900 0 0 2 2 15.87 28.89 5.5859 1 0 0 6 16.81 100.00 5.2730 1 0 1 12 19.39 6.68 4.5780 1 0 2 12 22.25 1.24 3.9950 0 0 4 2 23.07 2.86 3.8549 1 0 3 12 27.45 2.98 3.2495 1 0 4 12 29.88 11.55 2.9906 1 1 2 12 32.05 4.37 2.7929 2 0 0 6 32.27 14.12 2.7740 1 0 5 12 32.45 40.91 2.7588 1 1 3 12 32.55 21.20 2.7512 2 0 1 12 33.65 2.03 2.6633 0 0 6 2 34.00 2.40 2.6365 2 0 2 12 35.78 1.89 2.5094 1 1 4 12 37.41 2.86 2.4041 1 0 6 12 42.79 3.84 2.1132 1 0 7 12 43.22 1.42 2.0931 1 2 1 12 43.22 5.05 2.0931 2 1 1 12 44.10 21.28 2.0536 1 1 6 12 44.38 1.92 2.0412 1 2 2 12 48.92 9.16 1.8620 3 0 0 6 50.32 1.12 1.8134 3 0 2 12 51.72 4.01 1.7675 2 0 7 12 51.90 2.31 1.7616 1 2 5 12 51.90 2.65 1.7616 2 1 5 12 54.00 2.48 1.6982 1 1 8 12 55.54 2.91 1.6545 1 2 6 12 59.42 1.71 1.5554 1 1 9 12 59.65 5.63 1.5500 1 2 7 12 59.65 2.49 1.5500 2 1 7 12 59.99 1.61 1.5420 3 1 1 12 60.91 1.48 1.5209 1 3 2 12 64.19 1.57 1.4510 2 1 8 12 64.51 1.24 1.4444 3 1 4 12 67.15 2.32 1.3941 3 1 5 12 67.15 2.04 1.3941 1 3 5 12 67.30 1.90 1.3912 4 0 1 12 67.96 3.15 1.3794 2 2 6 12 68.95 1.41 1.3620 3 0 8 12 73.48 1.37 1.2888 2 0 11 12 73.94 1.70 1.2819 1 3 7 12 74.09 1.21 1.2796 4 0 5 12 74.24 1.83 1.2774 2 3 1 12 75.82 1.06 1.2547 2 2 8 12 78.46 1.30 1.2189 4 1 0 6 79.91 1.27 1.2005 1 0 13 12 87.54 1.91 1.1145 5 0 1 12 88.14 1.06 1.1084 1 4 6 12 ================================================================================ XPOW Copyright 1993 Bob Downs, Ranjini Swaminathan and Kurt Bartelmehs For reference, see Downs et al. (1993) American Mineralogist 78, 1104-1107.