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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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20137 580076 1 N3C22H27 A3B22C27 42.93 1.46 -8.7 -0.95 0
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20138 580088 1 NO8C29H39 AB8C29D39 -364.93 1.23 -9.64 -1.08 0
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20139 580125 1 FNO2C11H14 ABC2D11E14 -125.08 2.55 -9.66 -0.25 0
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20140 580142 2 N5C8H10 A5B8C10 108.57 2.5 -8.25 -0.21 0
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20141 580208 1 C5F6 A5B6 -230.84 0.73 -10.75 -1.76 0
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20142 580209 1 SO2N4C18H24 AB2C4D18E24 -61.29 2.25 -9.09 -0.97 0
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20144 580211 1 O4C11H14 A4B11C14 -144.81 1.73 -10.32 0.44 0
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20145 580231 2 NOC6H10 ABC6D10 -50.37 5.53 -9.22 0.79 0
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20146 580236 1 NO3C10H13 AB3C10D13 -116.46 4.81 -8.59 -0.07 0
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20147 580273 1 ON3C16H25 AB3C16D25 -43.18 3.71 -8.97 -0.41 0
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20148 580325 1 CoOH5F8C18 ABC5D8E18 -59.04 16.56 -11.46 -5.21 -7
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20149 580342 1 PO3C19H41 AB3C19D41 -274.54 1.47 -10.2 1.19 0
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20150 580364 1 PO3C19H41 AB3C19D41 -274.55 1.89 -10.17 1.17 0
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20151 580377 2 O2C5H8 A2B5C8 -195.61 5.21 -9.99 0.46 0
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20152 580388 1 NOC10H17 ABC10D17 -48.85 1.62 -9.02 0.55 0
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20153 580389 2 OC16H28 AB16C28 -75.95 2.77 -6.84 -0.05 0
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20154 580409 1 ClON2H11C12 ABC2D11E12 7.77 3.36 -8.47 -0.36 0
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20155 580446 1 PO3C13H27 AB3C13D27 -236.34 1.95 -10.39 1.2 0
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20156 580454 1 ClNOS2C14H18 ABCD2E14F18 -33.59 5.78 -8.67 -0.56 0
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20157 580458 1 SC2Cl2N2O2 AB2C2D2E2 -17.82 4.41 -11.47 -1.98 0
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20158 580459 1 SO2C4N5H7 AB2C4D5E7 -31.25 6.14 -8.85 -0.66 0
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20159 580491 2 O2H5C6 A2B5C6 -97.91 5.93 -9.27 -1.06 0
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20160 580492 1 BrO4H9C12 AB4C9D12 -93.91 6.12 -9.46 -1.01 0
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20161 580519 2 N2O2C7H8 A2B2C7D8 -31.95 9.02 -9.95 -1.77 0
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20162 580537 1 SO4F6H12C18 AB4C6D12E18 -426.18 4.46 -10.37 -1.17 0
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20163 580545 1 ClO3H9C12 AB3C9D12 -70.85 2.8 -9.57 -0.69 0
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20164 580652 1 ClSO2N4H13C14 ABC2D4E13F14 -31.88 3.2 -9.07 -0.87 0
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20165 580694 1 BrClN2O2H14C19 ABC2D2E14F19 -0.91 8.47 -8.96 -0.99 0
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20166 580698 1 ClNOSF3H13C16 ABCDE3F13G16 -170.38 2.02 -9.32 -0.84 0
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20167 580981 1 NiC12H18 AB12C18 51.1 3.0 -7.12 0.42 -8
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20168 581027 1 NC11H23 AB11C23 -17.78 1.61 -8.59 1.32 0
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20169 581051 1 NC10H21 AB10C21 -32.72 1.26 -8.28 2.88 0
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20170 581639 2 N2H8C11 A2B8C11 159.85 3.74 -8.57 -1.1 0
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20171 581675 1 N2C21H22 A2B21C22 74.65 4.66 -7.97 -0.5 0
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20172 581691 1 BrN2H11C16 AB2C11D16 109.47 0.91 -8.82 -1.02 0
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20173 581765 2 OC6H6 AB6C6 -22.76 2.79 -9.62 0.03 0
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20174 581767 1 NO2C13H17 AB2C13D17 -61.57 2.2 -9.4 -0.14 0
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20175 581825 2 NH11C14 AB11C14 153.8 2.06 -9.09 -1.0 0
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20176 581989 1 OSN3C9H17 ABC3D9E17 -25.15 1.78 -9.14 -0.55 0
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20177 581990 1 NF2H3O4C7 AB2C3D4E7 -132.17 4.42 -10.52 -2.16 0
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20178 582120 2 O2C5H9 A2B5C9 -209.22 2.45 -10.8 0.65 0
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20180 582349 1 OSF2N4H10C11 ABC2D4E10F11 -59.84 6.79 -9.11 -0.9 0
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20181 582351 1 N2O2H12C13 A2B2C12D13 -13.19 2.56 -10.15 -0.63 0
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20182 582375 1 C13H16 A13B16 48.25 0.41 -9.39 0.41 0
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20183 582437 1 Si2O3C33H64 A2B3C33D64 -341.98 2.41 -9.64 1.29 0
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20184 582438 1 SnCl2Si4C14H38 AB2C4D14E38 -222.91 5.11 -9.41 -0.48 0
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20185 582466 1 PSN2O3C11H15 ABC2D3E11F15 -158.28 3.03 -8.51 -0.42 0
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20186 582499 1 NSiO2C13H17 ABC2D13E17 -99.97 3.14 -8.51 -0.02 0
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20187 582544 2 NOC5H5 ABC5D5 2.79 4.52 -10.19 -1.23 0
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20188 582633 1 ON3H11C12 AB3C11D12 27.69 5.06 -8.83 -0.36 0