H32 N12 O16 P4 Averbuch-Pouchot M, Durif A European Journal of Solid State and Inorganic Chemistry 30 (1993) 471-482 (Tris)guanidinium cyclotriphosphate and (tetra)guanidinium cyclotetraphosphate: two new examples of organic-cation cyclophosphates _cod_database_code 1007204 _database_code_amcsd 0012577 CELL PARAMETERS: 9.6340 18.1120 7.2920 90.000 103.860 90.000 SPACE GROUP: P2_1/a X-RAY WAVELENGTH: 1.541838 Cell Volume: 1235.341 Density (g/cm3): 1.689 MAX. ABS. INTENSITY / VOLUME**2: 2.920522005 RIR: 0.563 RIR based on corundum from Acta Crystallographica A38 (1982) 733-739 2-THETA INTENSITY D-SPACING H K L Multiplicity 9.77 35.68 9.0560 0 2 0 2 10.65 100.00 8.3107 1 1 0 4 12.50 93.12 7.0797 0 0 1 2 13.43 5.25 6.5938 0 1 1 4 13.61 1.62 6.5062 1 2 0 4 14.61 23.51 6.0640 -1 1 1 4 15.89 42.56 5.5776 0 2 1 4 16.90 2.01 5.2458 -1 2 1 4 17.48 26.86 5.0725 1 3 0 4 18.11 81.02 4.8991 1 1 1 4 18.98 38.40 4.6767 2 0 0 2 19.61 6.52 4.5280 0 4 0 2 20.01 14.71 4.4363 1 2 1 4 20.17 2.52 4.4030 -1 3 1 4 20.69 2.83 4.2934 -2 1 1 4 21.38 25.69 4.1554 2 2 0 4 21.81 5.55 4.0756 1 4 0 4 22.38 5.94 3.9717 -2 2 1 4 22.86 5.83 3.8910 1 3 1 4 24.03 15.84 3.7032 -1 4 1 4 24.97 5.84 3.5660 -2 3 1 4 25.16 9.32 3.5398 0 0 2 2 25.16 10.57 3.5397 -1 1 2 4 25.21 9.51 3.5324 2 0 1 2 25.64 1.33 3.4741 0 1 2 4 25.69 2.76 3.4671 2 1 1 4 26.35 3.85 3.3827 1 4 1 4 26.38 7.79 3.3779 1 5 0 4 26.59 56.24 3.3528 -1 2 2 4 27.05 10.95 3.2969 0 2 2 4 27.10 14.16 3.2909 2 2 1 4 27.42 79.01 3.2531 2 4 0 4 27.66 15.67 3.2248 0 5 1 4 27.72 58.64 3.2177 -2 0 2 2 28.17 7.94 3.1681 -2 1 2 4 28.22 26.90 3.1627 -2 4 1 4 28.27 5.97 3.1567 -1 5 1 4 28.82 77.24 3.0979 -1 3 2 4 29.06 6.00 3.0726 3 1 0 4 29.25 1.02 3.0537 0 3 2 4 29.29 17.29 3.0489 2 3 1 4 29.46 26.69 3.0323 1 1 2 4 29.46 1.24 3.0320 -2 2 2 4 29.59 11.94 3.0187 0 6 0 2 30.08 2.04 2.9707 -3 2 1 4 30.29 3.57 2.9511 1 5 1 4 31.13 1.29 2.8728 1 6 0 4 31.23 7.85 2.8638 2 5 0 4 31.51 1.88 2.8396 -2 3 2 4 32.09 3.89 2.7891 -3 3 1 4 32.32 8.43 2.7702 3 3 0 4 32.68 4.68 2.7406 1 3 2 4 32.77 13.76 2.7329 -1 6 1 4 34.19 3.95 2.6229 -2 4 2 4 34.55 1.22 2.5962 1 6 1 4 34.73 7.37 2.5829 -3 4 1 4 34.92 16.14 2.5695 -3 2 2 4 35.10 4.41 2.5568 -1 5 2 4 35.27 6.68 2.5444 2 0 2 2 35.39 5.26 2.5362 2 6 0 4 35.46 3.31 2.5317 0 5 2 4 35.50 7.33 2.5290 2 5 1 4 35.54 1.28 2.5260 3 2 1 4 35.63 6.60 2.5196 2 1 2 4 36.01 10.73 2.4938 1 7 0 4 36.03 2.35 2.4927 -2 6 1 4 36.69 5.77 2.4492 -3 3 2 4 37.29 2.60 2.4115 3 3 1 4 37.38 7.24 2.4057 -2 5 2 4 37.84 1.30 2.3773 -4 1 1 4 37.89 8.41 2.3747 -3 5 1 4 38.13 1.49 2.3599 0 0 3 2 38.39 4.56 2.3449 -2 0 3 2 38.89 2.31 2.3155 -1 6 2 4 39.06 2.26 2.3061 -3 4 2 4 39.26 12.55 2.2949 2 6 1 4 39.46 1.58 2.2836 0 2 3 4 39.81 13.42 2.2641 4 2 0 4 39.82 1.58 2.2640 0 8 0 2 41.00 4.48 2.2015 -2 6 2 4 41.46 2.17 2.1777 -3 6 1 4 41.89 5.45 2.1564 0 8 1 4 41.93 2.37 2.1544 1 6 2 4 41.94 2.27 2.1543 -3 5 2 4 41.96 2.56 2.1529 1 1 3 4 42.32 1.02 2.1357 -1 8 1 4 42.43 8.30 2.1302 -3 1 3 4 42.47 4.11 2.1284 3 5 1 4 43.31 2.59 2.0891 3 1 2 4 43.35 2.39 2.0874 2 7 1 4 43.56 2.65 2.0777 4 4 0 4 43.76 1.41 2.0685 1 8 1 4 44.21 3.51 2.0486 3 2 2 4 44.39 1.49 2.0407 1 3 3 4 45.25 3.34 2.0040 -3 6 2 4 45.35 2.81 1.9996 -4 5 1 4 45.39 1.00 1.9981 -3 7 1 4 45.56 1.40 1.9911 3 7 0 4 45.69 3.29 1.9858 -4 4 2 4 47.33 2.56 1.9207 -1 9 1 4 47.68 6.10 1.9074 3 4 2 4 47.68 2.52 1.9073 0 8 2 4 48.06 2.67 1.8931 -1 6 3 4 48.20 1.06 1.8880 4 4 1 4 48.23 1.15 1.8868 2 2 3 4 49.20 1.14 1.8518 -2 6 3 4 49.29 3.17 1.8486 4 6 0 4 49.62 1.33 1.8374 -3 8 1 4 50.02 3.74 1.8233 1 8 2 4 50.16 4.35 1.8188 3 5 2 4 50.38 2.54 1.8114 -1 1 4 4 50.43 1.70 1.8095 -5 2 2 4 51.24 1.06 1.7830 -4 6 2 4 51.65 3.55 1.7698 -2 2 4 4 51.77 1.42 1.7660 -5 3 2 4 51.92 1.10 1.7611 1 6 3 4 52.09 2.53 1.7557 -4 4 3 4 52.12 1.06 1.7547 0 10 1 4 52.32 1.64 1.7486 2 9 1 4 52.48 2.37 1.7436 0 7 3 4 52.69 2.90 1.7371 0 2 4 4 52.77 1.56 1.7349 4 7 0 4 52.95 1.01 1.7294 -3 8 2 4 53.07 1.92 1.7256 3 6 2 4 53.55 1.94 1.7112 4 6 1 4 53.72 2.36 1.7063 1 10 1 4 53.72 2.03 1.7062 -2 9 2 4 54.10 1.26 1.6952 4 3 2 4 54.25 1.41 1.6908 3 9 0 4 54.31 2.12 1.6891 -1 4 4 4 54.32 2.28 1.6889 3 1 3 4 54.76 1.32 1.6764 -2 4 4 4 55.09 1.01 1.6670 -5 1 3 4 55.33 7.92 1.6604 -3 3 4 4 56.58 1.27 1.6265 4 8 0 4 56.77 1.44 1.6216 1 11 0 4 57.09 1.54 1.6133 -5 3 3 4 57.32 1.22 1.6074 1 3 4 4 57.68 1.31 1.5983 3 9 1 4 58.10 1.91 1.5875 4 5 2 4 58.25 1.02 1.5840 -4 2 4 4 58.84 2.97 1.5695 -3 10 1 4 59.46 1.15 1.5546 -4 3 4 4 59.70 2.46 1.5489 -2 6 4 4 59.80 1.44 1.5466 5 5 1 4 60.01 1.49 1.5415 -4 9 1 4 60.97 1.94 1.5197 -5 5 3 4 61.13 3.29 1.5160 -4 4 4 4 61.71 3.02 1.5032 -5 7 2 4 61.94 3.32 1.4980 -1 11 2 4 62.41 1.63 1.4879 -4 9 2 4 63.07 1.01 1.4740 6 4 0 4 63.46 1.72 1.4659 5 3 2 4 63.55 1.64 1.4641 -5 6 3 4 63.76 1.27 1.4597 1 6 4 4 64.18 1.78 1.4512 6 0 1 2 65.15 1.20 1.4319 -5 3 4 4 67.11 1.42 1.3947 5 5 2 4 67.48 1.81 1.3879 2 12 1 4 67.62 1.32 1.3855 -2 4 5 4 67.71 1.54 1.3839 -3 10 3 4 67.79 1.21 1.3823 2 11 2 4 68.35 1.55 1.3724 3 10 2 4 68.76 1.44 1.3653 -5 5 4 4 68.77 1.77 1.3651 4 10 1 4 68.82 1.00 1.3641 -6 7 1 4 69.21 2.02 1.3574 -4 11 1 4 70.02 1.17 1.3438 1 13 1 4 70.25 1.58 1.3398 -6 0 4 2 71.01 1.07 1.3275 4 9 2 4 71.34 1.04 1.3220 2 7 4 4 71.45 1.30 1.3203 -4 11 2 4 71.78 1.22 1.3151 -3 12 2 4 72.34 1.83 1.3063 5 2 3 4 74.06 1.32 1.2802 -6 7 3 4 75.04 1.25 1.2659 0 10 4 4 75.72 2.00 1.2562 7 1 1 4 76.74 1.42 1.2419 -7 6 2 4 77.02 1.22 1.2381 3 10 3 4 77.95 1.07 1.2257 2 4 5 4 79.59 1.70 1.2044 -2 2 6 4 82.65 1.37 1.1675 -7 8 2 4 82.92 1.27 1.1644 3 3 5 4 83.37 1.85 1.1592 7 1 2 4 84.84 1.24 1.1428 0 15 2 4 84.94 1.91 1.1418 -3 5 6 4 87.25 1.33 1.1174 5 13 0 4 ================================================================================ XPOW Copyright 1993 Bob Downs, Ranjini Swaminathan and Kurt Bartelmehs For reference, see Downs et al. (1993) American Mineralogist 78, 1104-1107.