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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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181899 76812439 1 N5O5C34H40 A5B5C34D40 -68.56 10.47 0.0 0.0 1
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181900 76812440 1 O4N5C30H34 A4B5C30D34 -47.15 11.33 0.0 0.0 0
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181901 76812441 1 O5N6C35H44 A5B6C35D44 -118.13 8.12 -9.51 -1.02 1
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181902 76812442 1 N5O5C33H38 A5B5C33D38 -83.38 11.6 0.0 0.0 1
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181903 76812443 1 N5O5C35H42 A5B5C35D42 -74.31 13.45 0.0 0.0 1
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181904 76812707 1 ON5C27H34 AB5C27D34 42.19 5.0 0.0 0.0 0
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181905 76812708 1 ON5C27H33 AB5C27D33 29.03 6.96 -9.11 0.18 0
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181906 76812768 1 F3O3N6C25H33 A3B3C6D25E33 -238.7 6.54 -8.96 -1.07 0
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181907 76812772 1 FN3O4C23H32 AB3C4D23E32 -222.6 3.22 -8.44 -0.02 1
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181908 76812818 1 N3O3C20H22 A3B3C20D22 -34.73 3.13 0.0 0.0 0
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181909 76812819 1 O3N5C21H25 A3B5C21D25 12.34 5.08 -8.91 -1.68 0
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181910 76812820 1 O3N5C24H31 A3B5C24D31 0.43 3.88 -8.68 -1.64 0
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181911 76812821 1 O2N3C16H17 A2B3C16D17 57.56 3.34 -8.46 -1.51 0
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181912 76812822 2 ON2C10H12 AB2C10D12 58.08 2.59 -8.65 -1.55 0
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181913 76812823 1 O3N5C22H27 A3B5C22D27 11.63 3.54 -8.81 -1.62 -1
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181914 76813385 1 C2W2O3Y3H7 A2B2C3D3E7 -288.2 4.65 -3.55 -0.34 0
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181915 76813386 1 NS2O3H21C24 AB2C3D21E24 1.13 3.84 -8.57 -0.9 0
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181916 76813387 1 O2N10H14C25 A2B10C14D25 259.21 5.86 -9.25 -2.1 0
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181917 76813388 1 NOC11H11 ABC11D11 25.42 3.32 -8.63 -0.78 0
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181918 76813931 1 ClFO2N4H24C25 ABC2D4E24F25 -1.6 6.25 -8.59 -0.88 0
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181919 76813932 1 O3N4C29H32 A3B4C29D32 7.47 12.57 -8.32 -0.81 0
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181920 76813933 1 O3N5C24H31 A3B5C24D31 -34.72 9.0 -8.51 -0.42 0
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181921 76814405 1 ClSF3O4N5H17C25 ABC3D4E5F17G25 -197.65 2.67 -9.12 -1.64 0
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181922 76814495 1 S2F3N5O5H24C25 A2B3C5D5E24F25 -258.13 3.96 -8.98 -1.36 0
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181923 76814496 1 ClS2F3N5O7H19C25 AB2C3D5E7F19G25 -339.42 5.46 -9.13 -1.42 0
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181924 76814514 1 ClSF3O3N4H22C25 ABC3D3E4F22G25 -185.11 4.51 -8.71 -1.25 0
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181925 76814515 1 ClSO2F3N4H24C26 ABC2D3E4F24G26 -169.48 4.2 -9.18 -1.29 0
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181926 76814520 1 ClSF3N4O4H20C25 ABC3D4E4F20G25 -231.69 3.38 -9.74 -1.36 0
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181927 76814521 1 ClSO2F4N4H25C27 ABC2D4E4F25G27 -214.72 3.47 -8.81 -1.2 0
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181928 76814971 1 FSO2N5C23H26 ABC2D5E23F26 -43.17 6.9 -8.59 -0.14 0
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181929 76815045 1 FN4O4C25H31 AB4C4D25E31 -150.43 2.94 -8.75 -0.48 0
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181930 76815046 1 O3N4C24H30 A3B4C24D30 -78.32 4.07 -8.65 -0.42 0
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181931 76815101 1 O3N4C23H28 A3B4C23D28 -65.8 6.71 -8.95 -0.69 0
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181932 76815141 2 N2C15H21 A2B15C21 15.38 1.59 -7.08 0.42 0
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181933 76815857 1 O4C15H24 A4B15C24 -199.23 5.91 -10.23 -0.38 0
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181934 76815878 1 N2O7C33H36 A2B7C33D36 -212.16 7.63 -8.46 -0.77 0
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181935 76816081 1 NH33C36 AB33C36 159.25 1.74 -8.26 -0.37 0
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181936 76816141 1 ON2C54H54 AB2C54D54 252.28 1.08 -7.86 -0.42 0
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181937 76816373 1 PN2O16C17H33 AB2C16D17E33 -754.61 6.28 -10.18 0.26 0
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181938 76816415 1 S2N12O19C68H88 A2B12C19D68E88 -595.79 8.35 -8.75 -1.18 0
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181939 76816483 1 ON2C15H16 AB2C15D16 -2.55 1.63 -8.21 -0.35 0
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181940 76816572 2 O3N4C22H37 A3B4C22D37 -328.69 10.96 -8.71 -0.18 0
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181941 76816766 1 O3C10H20 A3B10C20 -171.33 1.84 -9.89 1.74 0
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181942 76817037 1 N5O14C55H91 A5B14C55D91 -739.3 8.62 -8.99 -0.2 0
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181943 76817098 1 SO8N9C57H87 AB8C9D57E87 -379.66 9.95 -8.53 -0.45 0
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181944 76817254 1 N3O5C28H37 A3B5C28D37 -179.6 7.26 -9.19 -0.37 0
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181945 76817939 1 N6O6C55H72 A6B6C55D72 -187.67 4.21 -8.27 -0.22 0
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181946 76818045 1 SO2N4C23H30 AB2C4D23E30 -9.04 3.28 -8.48 -0.16 0
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181947 76818182 1 N2O2C15H18 A2B2C15D18 -48.99 2.09 -9.58 0.01 0
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181948 76818661 1 OC20H30 AB20C30 -38.01 2.98 -8.53 -0.13 0