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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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224814 85389160 1 OSTeWC11H11 ABCDE11F11 -98.09 4.02 0.0 0.0 0
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224815 85392679 1 NSiO10C36H47 ABC10D36E47 -332.5 8.68 -8.82 -1.06 0
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224816 85395733 1 SiO4C27H44 AB4C27D44 -213.09 1.88 -8.78 0.6 0
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224817 85402679 1 SiO3C21H34 AB3C21D34 -166.38 2.25 -8.97 0.29 0
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224818 85403370 1 NVO4C23H41 ABC4D23E41 -271.08 6.19 0.0 0.0 0
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224819 85404544 2 SiO3C26H37 AB3C26D37 -314.7 4.31 -8.74 0.01 0
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224820 85406103 1 SiO2N3C16H33 AB2C3D16E33 -116.78 4.58 -9.08 0.25 0
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224821 85411833 2 N2O3C22H22 A2B3C22D22 -140.57 1.74 -8.77 -0.64 0
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224822 85412953 1 FSO2C14H19 ABC2D14E19 -106.26 3.21 -8.34 -0.03 0
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224823 85415732 20 C3H4 A3B4 102.32 2.44 -7.7 -0.4 0
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224824 85417679 1 NO5C22H35 AB5C22D35 -253.34 2.64 -9.89 0.11 0
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224825 85421198 1 PN2O6C15H25 AB2C6D15E25 -317.13 5.3 -9.95 -0.13 0
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224826 85421766 1 NO6C23H35 AB6C23D35 -242.37 1.28 -8.28 -0.13 0
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224827 85422721 1 Cl2O3N4C29H30 A2B3C4D29E30 -57.9 3.87 -8.3 -0.41 0
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224828 85423584 1 O12N16C53H76 A12B16C53D76 -481.29 9.95 -8.5 0.0 0
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224829 85427132 1 O11C54H58 A11B54C58 -317.54 3.73 -9.46 -0.16 1
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224830 85427679 1 N2O3C12H19 A2B3C12D19 -57.67 6.83 0.0 0.0 0
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224832 85433311 1 NSO3H15C16 ABC3D15E16 -53.98 3.73 -8.81 -1.4 0
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224833 85434548 1 O4N7C30H41 A4B7C30D41 -128.65 6.89 -8.83 -0.51 0
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224834 85437576 1 OSN2C13H18 ABC2D13E18 -29.39 6.28 -8.48 -0.07 0
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224835 85438352 1 ClN4H15C21 AB4C15D21 156.2 7.65 -9.27 -1.36 0
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224836 85439556 1 NO2H9C10 AB2C9D10 -23.38 5.75 -9.49 -1.57 0
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224837 85441075 1 SO2H14C17 AB2C14D17 -8.2 2.12 -8.83 -0.64 0
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224838 85444484 1 NO2C15H17 AB2C15D17 -51.95 3.21 -9.46 -0.39 0
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224839 85446390 1 ClBr2O5H21C32 AB2C5D21E32 -88.85 4.73 -8.88 -1.88 0