Na2 O7 P2 Pd Laligant Y European Journal of Solid State and Inorganic Chemistry 29 (1992) 83-94 Structure determination of Na2PdP2O7 from X-ray powder diffraction _cod_database_code 1000337 _database_code_amcsd 0012547 CELL PARAMETERS: 14.6930 5.8551 7.9220 90.000 114.110 90.000 SPACE GROUP: C2/c X-RAY WAVELENGTH: 1.541838 Cell Volume: 622.068 Density (g/cm3): 3.484 MAX. ABS. INTENSITY / VOLUME**2: 21.03454305 RIR: 1.966 RIR based on corundum from Acta Crystallographica A38 (1982) 733-739 2-THETA INTENSITY D-SPACING H K L Multiplicity 13.20 67.83 6.7056 2 0 0 2 16.52 55.73 5.3660 1 1 0 4 18.92 43.01 4.6917 -1 1 1 4 22.18 6.46 4.0071 1 1 1 4 22.68 9.50 3.9210 -2 0 2 2 24.05 10.07 3.6996 -3 1 1 4 24.62 4.29 3.6155 0 0 2 2 25.06 55.08 3.5532 3 1 0 4 26.59 3.78 3.3528 4 0 0 2 27.40 92.42 3.2550 -1 1 2 4 27.94 19.23 3.1934 -4 0 2 2 28.96 100.00 3.0837 -3 1 2 4 30.54 7.41 2.9276 0 2 0 2 31.45 11.22 2.8443 3 1 1 4 32.03 17.09 2.7942 1 1 2 4 32.59 32.46 2.7478 2 0 2 2 33.01 9.97 2.7136 0 2 1 4 33.40 16.28 2.6830 2 2 0 4 34.16 18.96 2.6246 -5 1 1 4 35.97 4.54 2.4967 -5 1 2 4 36.86 14.09 2.4385 5 1 0 4 37.62 4.11 2.3912 2 2 1 4 37.69 7.30 2.3866 -6 0 2 2 38.37 4.63 2.3458 -2 2 2 4 39.61 12.12 2.2752 0 2 2 4 40.92 35.39 2.2052 4 2 0 4 40.99 9.81 2.2019 3 1 2 4 41.78 1.43 2.1621 -5 1 3 4 41.86 16.54 2.1580 -4 2 2 4 43.34 4.30 2.0878 5 1 1 4 43.61 1.70 2.0755 1 1 3 4 43.68 1.07 2.0723 4 0 2 2 45.26 7.59 2.0035 2 2 2 4 46.31 13.77 1.9606 -7 1 2 4 46.31 7.97 1.9605 -4 0 4 2 46.34 2.93 1.9593 -2 2 3 4 46.37 8.44 1.9580 -2 0 4 2 47.05 5.32 1.9314 1 3 0 4 47.84 2.75 1.9012 -4 2 3 4 48.64 2.36 1.8718 -6 2 1 4 49.26 4.10 1.8498 -6 2 2 4 49.73 3.48 1.8333 -8 0 2 2 50.10 3.78 1.8209 7 1 0 4 50.31 3.29 1.8138 -6 0 4 2 50.46 7.27 1.8087 -5 1 4 4 50.49 2.66 1.8077 0 0 4 2 50.58 11.66 1.8047 -1 1 4 4 51.06 9.06 1.7887 3 3 0 4 51.44 17.13 1.7766 6 2 0 4 52.38 5.28 1.7468 -1 3 2 4 52.48 6.77 1.7436 5 1 2 4 54.23 2.15 1.6914 4 2 2 4 54.76 6.90 1.6764 8 0 0 2 55.22 4.59 1.6633 1 3 2 4 55.24 5.83 1.6630 2 2 3 4 56.07 4.50 1.6402 -7 1 4 4 56.29 4.28 1.6342 1 1 4 4 56.49 7.03 1.6290 -4 2 4 4 56.55 4.81 1.6275 -2 2 4 4 56.56 3.98 1.6270 6 0 2 2 56.72 2.02 1.6229 7 1 1 4 57.86 10.48 1.5936 -5 3 2 4 58.01 1.35 1.5898 2 0 4 2 58.71 1.70 1.5726 -9 1 2 4 59.07 1.34 1.5639 -3 3 3 4 59.49 1.99 1.5538 -8 2 2 4 60.00 3.09 1.5418 -6 2 4 4 60.16 2.19 1.5381 0 2 4 4 60.81 1.37 1.5233 -3 1 5 4 61.48 12.61 1.5082 3 3 2 4 61.70 2.99 1.5034 -8 2 3 4 63.87 1.30 1.4575 -1 1 5 4 64.53 2.93 1.4441 9 1 0 4 64.74 3.40 1.4400 -9 1 4 4 65.04 3.13 1.4340 3 1 4 4 65.24 3.89 1.4301 2 4 0 4 65.58 7.67 1.4235 -7 3 2 4 65.65 2.90 1.4222 6 2 2 4 65.77 4.67 1.4198 7 1 2 4 66.73 4.61 1.4018 -8 2 4 4 66.98 4.79 1.3971 2 2 4 4 67.36 6.82 1.3901 -3 3 4 4 67.92 1.86 1.3801 -10 0 4 2 68.27 1.66 1.3739 4 0 4 2 68.41 1.97 1.3713 -2 4 2 4 68.65 2.88 1.3672 7 3 0 4 68.94 2.54 1.3620 -5 3 4 4 69.04 1.01 1.3603 -1 3 4 4 69.25 5.37 1.3568 0 4 2 4 70.15 2.25 1.3415 4 4 0 4 70.18 4.60 1.3411 10 0 0 2 70.63 2.75 1.3336 5 3 2 4 70.81 2.23 1.3306 -4 4 2 4 71.80 1.09 1.3147 -9 1 5 4 71.95 2.02 1.3123 -10 2 2 4 72.84 5.26 1.2985 -11 1 2 4 73.61 3.35 1.2868 -5 1 6 4 74.02 2.03 1.2807 -2 0 6 2 74.47 2.58 1.2740 -3 1 6 4 75.34 1.06 1.2615 -11 1 1 4 75.90 1.44 1.2536 -7 1 6 4 75.96 1.19 1.2527 -11 1 4 4 76.00 2.10 1.2522 -9 3 2 4 76.15 1.82 1.2500 -8 0 6 2 76.27 1.38 1.2484 -10 2 4 4 76.61 1.68 1.2438 4 2 4 4 78.03 3.85 1.2246 6 4 0 4 79.21 1.21 1.2093 8 2 2 4 79.54 1.90 1.2052 0 0 6 2 79.78 1.23 1.2021 -4 2 6 4 80.47 2.60 1.1935 -6 2 6 4 80.86 2.27 1.1887 9 1 2 4 81.22 1.03 1.1844 9 3 0 4 81.24 1.21 1.1842 -9 1 6 4 82.23 1.18 1.1724 -2 4 4 4 82.73 1.19 1.1666 1 5 0 4 83.02 1.04 1.1632 -10 0 6 2 85.32 1.67 1.1376 0 4 4 4 85.40 1.82 1.1368 1 1 6 4 85.77 1.07 1.1328 3 5 0 4 86.81 2.38 1.1219 -1 5 2 4 87.54 1.18 1.1144 -3 5 2 4 88.89 1.01 1.1009 6 2 4 4 89.73 1.05 1.0928 -5 3 6 4 ================================================================================ XPOW Copyright 1993 Bob Downs, Ranjini Swaminathan and Kurt Bartelmehs For reference, see Downs et al. (1993) American Mineralogist 78, 1104-1107.