C24H38N2O4*H20 Marsh R E, Herbstein F H Acta Crystallographica B44 (1988) 77-88 More space-group changes _database_code_amcsd 0009823 CELL PARAMETERS: 18.9430 11.3180 24.3760 90.000 94.500 90.000 SPACE GROUP: C2/c X-RAY WAVELENGTH: 1.541838 Cell Volume: 5210.028 Density (g/cm3): 1.021 MAX. ABS. INTENSITY / VOLUME**2: 2.880061665 RIR: 0.919 RIR based on corundum from Acta Crystallographica A38 (1982) 733-739 2-THETA INTENSITY D-SPACING H K L Multiplicity 7.28 22.60 12.1504 0 0 2 2 9.11 100.00 9.7080 1 1 0 4 9.37 3.82 9.4423 2 0 0 2 9.67 18.50 9.1432 -1 1 1 4 9.95 16.40 8.8925 1 1 1 4 11.41 58.16 7.7564 -2 0 2 2 11.90 35.79 7.4395 1 1 2 4 12.31 2.90 7.1875 2 0 2 2 13.95 8.40 6.3468 -1 1 3 4 14.52 29.70 6.0997 1 1 3 4 14.58 57.37 6.0752 0 0 4 2 15.66 1.49 5.6590 0 2 0 2 16.08 2.28 5.5115 0 2 1 4 16.27 1.78 5.4465 -3 1 1 4 16.72 7.06 5.3019 -2 0 4 2 16.77 30.78 5.2880 3 1 1 4 16.90 13.78 5.2460 -1 1 4 4 17.53 8.29 5.0590 1 1 4 4 17.97 1.29 4.9359 2 0 4 2 18.15 3.41 4.8872 3 1 2 4 18.28 4.19 4.8540 2 2 0 4 18.49 14.34 4.7973 -2 2 1 4 18.80 6.05 4.7212 4 0 0 2 18.87 7.14 4.7033 -3 1 3 4 19.13 10.68 4.6390 0 2 3 4 19.42 3.80 4.5716 -2 2 2 4 19.63 1.19 4.5220 -4 0 2 2 20.12 12.87 4.4125 3 1 3 4 20.71 2.26 4.2885 4 0 2 2 20.77 1.11 4.2775 1 1 5 4 21.72 4.07 4.0915 2 2 3 4 22.54 4.04 3.9454 3 1 4 4 22.93 16.45 3.8782 -4 0 4 2 22.99 3.68 3.8691 -2 2 4 4 23.21 1.56 3.8327 -2 0 6 2 23.58 6.83 3.7729 -3 1 5 4 23.92 1.01 3.7198 2 2 4 4 24.14 1.44 3.6870 0 2 5 4 24.56 1.59 3.6252 4 2 0 4 24.59 4.28 3.6207 2 0 6 2 24.61 3.29 3.6175 -4 2 1 4 24.77 4.17 3.5937 4 0 4 2 24.85 8.23 3.5831 -5 1 1 4 25.05 7.81 3.5544 4 2 1 4 25.21 2.21 3.5327 -4 2 2 4 25.27 1.36 3.5244 3 1 5 4 25.39 2.12 3.5080 -5 1 2 4 25.41 1.11 3.5059 -2 2 5 4 26.07 3.66 3.4179 4 2 2 4 26.32 4.41 3.3859 -4 2 3 4 26.33 1.50 3.3849 -1 3 3 4 26.47 1.79 3.3672 2 2 5 4 26.64 1.47 3.3458 1 3 3 4 27.07 1.01 3.2935 0 2 6 4 27.56 3.39 3.2370 4 2 3 4 27.88 2.32 3.2006 -4 0 6 2 27.89 1.15 3.1991 -4 2 4 4 27.95 3.35 3.1917 -5 1 4 4 28.12 2.36 3.1734 -2 2 6 4 28.24 8.85 3.1598 3 1 6 4 28.36 10.96 3.1474 6 0 0 2 28.74 1.58 3.1066 -6 0 2 2 29.28 2.08 3.0499 2 2 6 4 29.47 3.92 3.0312 -3 1 7 4 29.88 6.02 2.9904 6 0 2 2 30.13 7.57 2.9658 -1 3 5 4 30.48 2.21 2.9329 -1 1 8 4 30.78 2.25 2.9051 -3 3 4 4 30.96 4.69 2.8888 -6 0 4 2 31.06 3.14 2.8792 -2 2 7 4 31.64 2.54 2.8277 2 0 8 2 31.67 1.87 2.8254 4 2 5 4 31.85 2.28 2.8095 3 3 4 4 32.10 1.52 2.7884 -5 1 6 4 32.55 2.11 2.7506 6 2 0 4 33.57 1.82 2.6693 -5 3 1 4 33.57 1.25 2.6692 5 3 0 4 33.89 2.82 2.6448 3 3 5 4 34.70 1.57 2.5855 -6 0 6 2 34.98 1.52 2.5650 0 4 4 4 35.17 2.76 2.5518 6 2 3 4 36.03 3.20 2.4924 -3 1 9 4 36.75 1.80 2.4453 0 4 5 4 36.99 1.09 2.4301 0 0 10 2 37.39 1.94 2.4054 4 4 1 4 37.46 2.96 2.4006 -4 2 8 4 37.63 1.13 2.3902 -2 4 5 4 38.27 4.62 2.3516 -6 2 6 4 38.39 2.75 2.3449 7 1 4 4 38.55 1.20 2.3353 1 1 10 4 39.58 2.40 2.2768 -6 0 8 2 40.76 1.42 2.2137 -1 5 2 4 42.50 1.34 2.1268 -3 5 1 4 42.71 1.89 2.1170 3 5 1 4 43.04 1.68 2.1015 1 5 4 4 43.88 1.41 2.0631 9 1 0 4 44.06 1.52 2.0553 6 4 2 4 44.71 1.34 2.0270 -3 5 4 4 44.86 1.64 2.0206 7 1 7 4 45.32 1.20 2.0009 -6 0 10 2 45.81 1.23 1.9808 2 2 11 4 46.10 1.85 1.9690 -6 4 5 4 46.51 1.10 1.9525 4 4 7 4 46.72 1.04 1.9441 -3 1 12 4 47.44 1.14 1.9164 -4 0 12 2 49.74 1.12 1.8329 -2 6 2 4 50.10 1.14 1.8209 5 1 11 4 ================================================================================ XPOW Copyright 1993 Bob Downs, Ranjini Swaminathan and Kurt Bartelmehs For reference, see Downs et al. (1993) American Mineralogist 78, 1104-1107.