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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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232978 87577855 1 SF3N4O4H19C23 AB3C4D4E19F23 -229.55 7.43 -9.34 -1.27 0
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232979 87577856 1 F3N3O3C17H18 A3B3C3D17E18 -198.77 5.49 -9.81 -0.73 0
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232980 87577859 1 ClN4O4C14H19 AB4C4D14E19 -156.6 4.78 -9.56 -1.46 0
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232981 87577869 1 S2O3C7H8 A2B3C7D8 -71.49 5.81 -9.66 -1.21 0
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232982 87577871 1 ClNOC9H16 ABCD9E16 3.83 1.19 -9.06 0.25 0
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232983 87577874 1 NO4C11H11 AB4C11D11 -111.59 6.17 -9.19 -1.47 0
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232984 87577875 2 SiO2C5H10 AB2C5D10 -124.36 5.32 -5.74 -1.88 0
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232985 87577876 1 OSiH10C12 ABC10D12 85.31 1.33 -7.51 -1.52 0
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232986 87577877 1 NOSCl3C10H16 ABCD3E10F16 -74.44 4.05 -9.39 -0.75 0
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232987 87577878 1 O3C16H16 A3B16C16 -17.14 2.79 -9.42 -0.57 0
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232988 87577879 1 NSO3C14H21 ABC3D14E21 -130.75 6.64 -9.22 -0.66 0
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232989 87577880 2 O2C11H15 A2B11C15 -164.18 7.39 -9.41 -1.14 0
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232990 87577881 2 BrO2N3C24H27 AB2C3D24E27 -12.0 4.31 -8.05 -0.7 0
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232991 87577884 1 ClO3H11C12 AB3C11D12 -44.52 7.06 -8.96 -1.06 0
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232992 87577892 1 NOC11H21 ABC11D21 -35.14 1.43 -9.36 0.69 0
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232993 87577894 1 SO2P2H26C36 AB2C2D26E36 40.29 4.91 -8.48 -0.74 0
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232994 87577904 1 SN2O2C10H18 AB2C2D10E18 -82.15 4.55 -9.44 -0.43 0
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232995 87577908 1 SN2O5H18C21 AB2C5D18E21 -137.64 4.78 -9.21 -1.55 0
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232996 87577912 1 ClFN2S2O6H22C24 ABC2D2E6F22G24 -203.98 6.84 -9.17 -1.27 0
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232997 87577913 1 BrN2O4C25H29 AB2C4D25E29 -149.11 7.25 -9.05 -2.1 0
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232999 87577918 1 S2O4F14H18C31 A2B4C14D18E31 -788.26 2.15 -10.14 -1.34 0
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233000 87577920 1 ClFNO3H9C11 ABCD3E9F11 -84.69 4.3 -10.22 -1.32 0
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233001 87577921 1 OCl2N4F6C26H28 AB2C4D6E26F28 -345.6 4.5 -9.17 -1.73 0
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233002 87577925 1 ClON3C18H22 ABC3D18E22 7.95 6.23 -8.77 -0.96 0
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233003 87577926 1 S2N3C11H13 A2B3C11D13 43.08 6.53 -8.63 -0.72 0
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233004 87577933 1 ON5C24H25 AB5C24D25 107.11 6.25 -7.63 -0.28 0
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233005 87577935 1 PO4Cl6C9H9 AB4C6D9E9 -240.4 2.48 -10.14 -0.44 0
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233006 87577939 4 OC3H5 AB3C5 -181.6 4.79 -10.52 -0.12 1
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233007 87577949 1 SiN2C5H13 AB2C5D13 4.37 4.47 0.0 0.0 2
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233008 87577951 1 NP2O5C9H21 AB2C5D9E21 -277.52 3.67 -8.81 -0.34 0
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233009 87577954 1 NSO4C11H11 ABC4D11E11 -82.46 1.65 -8.58 -1.03 0
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233010 87577958 1 BrSiO5C13H27 ABC5D13E27 -346.76 5.53 -9.5 -0.63 0
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233011 87577962 1 ON2C13H24 AB2C13D24 -50.98 2.78 -8.94 0.38 0
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233012 87577963 1 N6O12C55H104 A6B12C55D104 -703.64 5.69 -9.54 0.11 0
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233013 87577981 1 FS2N6O7C27H31 AB2C6D7E27F31 -214.79 6.6 -9.15 -1.19 0
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233014 87577983 1 SH30C34 AB30C34 98.34 1.79 -8.59 -0.04 0
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233015 87677941 1 N2O6F17C23H31 A2B6C17D23E31 -1106.0 4.81 -9.64 -0.63 0
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233016 87690733 1 ClNC13H20 ABC13D20 10.4 11.44 -8.2 -0.63 0
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233017 87690777 1 NOS2C36H73 ABC2D36E73 -194.54 4.86 -8.68 -0.41 0
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233018 87690778 1 SiO4C23H33 AB4C23D33 -131.55 1.38 0.0 0.0 0
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233019 87691223 2 NSC5H11 ABC5D11 -15.86 5.21 -8.68 -0.41 0
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233020 87691253 1 NO2C9H17 AB2C9D17 -105.0 1.09 -9.92 -0.5 0
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233021 87691307 1 N3C10H21 A3B10C21 27.48 3.95 -8.18 1.19 0
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233022 87691329 1 ON2S2C29H56 AB2C2D29E56 -126.08 2.63 -8.68 -0.41 0
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233023 87691345 1 NOS2C11H23 ABC2D11E23 -69.35 5.01 -8.7 -0.43 0
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233024 87691365 1 ON2S2C8H14 AB2C2D8E14 -20.42 6.07 -8.76 -0.5 0
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233025 87691435 2 ClN2O2C10H18 AB2C2D10E18 -188.07 4.06 -9.42 -0.42 0
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233026 87691459 1 ClNO3C19H34 ABC3D19E34 -114.52 2.64 -9.37 0.22 0
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233027 87691467 1 ClN2O2C10H21 AB2C2D10E21 -98.45 2.26 -9.38 -0.03 0
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233028 87691479 1 BrN2O4C14H27 AB2C4D14E27 -197.63 2.07 -9.61 -1.57 0