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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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387021 134983695 1 N2O5H24C27 A2B5C24D27 -23.58 6.85 -8.81 -1.44 0
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387022 134983700 3 C5H6 A5B6 11.79 0.84 -8.25 -0.07 0
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387023 134983704 1 SiO3C20H38 AB3C20D38 -235.59 1.67 -8.69 0.68 0
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387024 134983716 1 OC17H24 AB17C24 -25.29 2.19 -9.17 0.12 0
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387025 134983717 1 NSO4C14H15 ABC4D14E15 -34.53 6.26 -9.09 -1.72 0
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387026 134983727 1 Cl2N6H16C17 A2B6C16D17 111.08 6.09 -8.68 -1.16 0
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387027 134983729 1 SbN3Cl6C13H16 AB3C6D13E16 -59.81 16.85 -10.58 -1.85 0
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387028 134983736 1 FN4C6O6H11 AB4C6D6E11 -61.75 4.86 -11.13 -2.01 0
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387029 134983737 1 N2O2C5H12 A2B2C5D12 -25.11 5.46 -10.14 -0.22 0
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387030 134983738 2 NOC5H5 ABC5D5 70.98 1.21 -9.54 -0.91 0
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387031 134983743 1 BrN2O3C10H17 AB2C3D10E17 -79.94 5.86 -10.22 -0.64 0
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387032 134983744 2 N2O3C4H4 A2B3C4D4 14.78 7.32 -11.03 -2.14 0
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387033 134983746 1 BrN2C19H23 AB2C19D23 34.25 3.8 -8.44 0.13 0
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387034 134983751 1 SN3O5C31H37 AB3C5D31E37 -102.46 6.61 -8.65 -0.46 0
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387035 134983757 1 NCl2O2C14H17 AB2C2D14E17 -67.75 1.53 -9.43 -0.31 0
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387036 134983762 1 NO6C21H23 AB6C21D23 -200.81 3.38 -9.73 -0.38 0
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387037 134983764 1 NO2C22H27 AB2C22D27 -35.36 1.26 -9.28 0.2 0
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387038 134983766 1 NSO6C26H31 ABC6D26E31 -184.94 6.89 -9.57 -0.64 0
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387039 134983768 1 NCl3H12C15 AB3C12D15 60.32 1.53 -9.58 -0.42 0
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387040 134983771 1 NO2H23C24 AB2C23D24 13.06 1.62 -9.28 0.07 0
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387041 134983776 1 NSO2C23H29 ABC2D23E29 -39.63 4.8 -8.88 -0.03 0
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387042 134983777 1 NOSC21H23 ABCD21E23 41.93 0.96 -9.09 -0.18 0
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387043 134983779 1 NO4C26H27 AB4C26D27 -61.72 3.24 -9.35 -0.21 0
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387044 134983780 1 N3O8C15H19 A3B8C15D19 -266.96 2.32 -9.71 -0.6 0
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387045 134983781 1 N2O8C9H14 A2B8C9D14 -201.44 4.03 -11.52 -1.13 0
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387046 134983782 1 NO4H27C29 AB4C27D29 -0.17 5.97 -8.85 -0.43 0
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387047 134983783 1 NO2C18H25 AB2C18D25 -6.19 4.13 -9.67 -0.37 0
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387048 134983784 1 NOC6F13 ABC6D13 -633.39 0.98 -11.3 -2.58 0
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387049 134983788 1 NO3H9C11 AB3C9D11 32.14 2.55 -10.02 -1.27 0
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387050 134983790 1 N2O7C21H22 A2B7C21D22 -167.32 3.41 -9.71 -1.17 0
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387051 134983791 1 SN2O4C23H26 AB2C4D23E26 -51.68 3.24 -8.94 -0.58 0
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387052 134983792 1 SN2O5C17H22 AB2C5D17E22 -98.06 6.11 -9.6 -0.58 0
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387053 134983795 1 N2O5C21H30 A2B5C21D30 -135.5 2.86 -9.37 -0.39 0
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387054 134983797 1 NSiO7C20H33 ABC7D20E33 -251.48 6.37 -9.12 -0.8 0
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387055 134983798 1 NO4C13H17 AB4C13D17 -89.17 5.16 -9.85 -0.74 0
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387056 134983799 1 N2O3C8H16 A2B3C8D16 -76.23 7.65 -10.0 -0.39 0
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387057 134983803 1 SN2O3C15H26 AB2C3D15E26 -97.54 14.15 -9.48 -0.96 0
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387058 134983806 4 OSN2C5H10 ABC2D5E10 -87.4 3.69 -7.69 -0.7 0
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387059 134983807 1 NBr2O4C11H11 AB2C4D11E11 -90.86 4.63 -9.81 -1.04 0
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387060 134983817 1 NOSeC21H27 ABCD21E27 19.34 2.16 -8.45 -0.3 0
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387061 134983819 1 NSiO4C21H31 ABC4D21E31 -169.99 2.94 -8.94 -0.03 0
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387062 134983825 1 PC25H29 AB25C29 11.8 1.73 -8.52 0.4 0
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387063 134983826 1 PC26H31 AB26C31 6.91 1.98 -8.51 0.42 0
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387064 134983827 1 PWSi2O5C12H20 ABC2D5E12F20 -226.66 5.03 0.0 0.0 0
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387065 134983829 1 PWO5C15H17 ABC5D15E17 -155.74 5.68 -6.92 0.64 0
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387066 134983833 1 FeNPC12H15 ABCD12E15 35.18 1.95 0.0 0.0 0
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387067 134983835 1 FeNPC13H17 ABCD13E17 69.33 2.63 0.0 0.0 0
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387070 134983842 1 N3C6H11 A3B6C11 65.65 3.46 -9.76 0.09 0
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387071 134983843 1 O4N5C16H19 A4B5C16D19 -36.22 6.1 -9.51 -1.92 0
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387072 134983851 1 Br4N4O5H10C15 A4B4C5D10E15 14.76 5.88 -10.49 -1.94 1