Urea Swaminathan S, Craven B M Acta Crystallographica B40 (1984) 300-306 The crystal structure and molecular thermal motion of urea at 12, 60 and 123 K from neutron diffraction Note: neutron data, T = 123 K Locality: synthetic _database_code_amcsd 0020672 CELL PARAMETERS: 5.5840 5.5840 4.6890 90.000 90.000 90.000 SPACE GROUP: P-42_1m X-RAY WAVELENGTH: 1.541838 Cell Volume: 146.208 Density (g/cm3): 1.364 MAX. ABS. INTENSITY / VOLUME**2: 9.633665053 RIR: 2.300 RIR based on corundum from Acta Crystallographica A38 (1982) 733-739 2-THETA INTENSITY D-SPACING H K L Multiplicity 22.52 100.00 3.9485 1 1 0 4 24.79 22.14 3.5909 1 0 1 8 29.58 27.68 3.0203 1 1 1 4 32.06 6.58 2.7920 2 0 0 4 35.96 14.28 2.4972 2 1 0 8 37.49 11.69 2.3989 2 0 1 8 38.39 1.53 2.3445 0 0 2 2 40.95 4.44 2.2041 2 1 1 8 41.79 5.89 2.1617 1 0 2 8 44.97 1.84 2.0159 1 1 2 4 45.97 5.45 1.9742 2 2 0 4 50.14 6.16 1.8195 2 2 1 4 52.93 2.63 1.7300 3 0 1 8 53.62 1.52 1.7093 2 1 2 8 55.62 6.96 1.6525 3 1 1 8 61.39 1.01 1.5101 2 2 2 4 61.62 1.42 1.5051 1 0 3 8 70.37 1.51 1.3380 4 0 1 8 71.16 1.89 1.3249 2 1 3 8 71.71 1.92 1.3162 3 3 0 4 76.26 1.26 1.2486 4 2 0 8 82.40 1.42 1.1704 3 1 3 8 ================================================================================ XPOW Copyright 1993 Bob Downs, Ranjini Swaminathan and Kurt Bartelmehs For reference, see Downs et al. (1993) American Mineralogist 78, 1104-1107.