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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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231088 87572604 1 ClO3N10C25H25 AB3C10D25E25 42.21 12.06 -9.39 -1.24 0
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231089 87572606 1 SN3O4C20H29 AB3C4D20E29 -83.54 2.11 -8.49 -0.56 0
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231090 87572609 1 F2S2N3O7H27C31 A2B2C3D7E27F31 -227.06 3.86 -8.95 -1.39 0
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231091 87572610 1 NCl2O2C5H11 AB2C2D5E11 -127.06 4.92 -10.32 0.11 0
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231092 87572614 1 ON3C15H27 AB3C15D27 -36.91 3.87 -8.49 1.12 0
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231093 87572617 1 O2N4C21H22 A2B4C21D22 14.95 4.59 -8.89 -1.18 0
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231094 87572626 1 SO5C19H20 AB5C19D20 -128.48 4.62 -7.99 -0.66 0
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231095 87572627 2 N4O6C34H47 A4B6C34D47 -486.24 9.76 -8.85 -0.22 0
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231096 87572633 1 N2F3O9C26H33 A2B3C9D26E33 -504.32 2.97 -9.13 -0.3 0
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231097 87572634 1 NPSC20H42 ABCD20E42 -79.65 16.99 -7.33 0.89 0
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231098 87572635 1 NPSC20H42 ABCD20E42 -85.14 8.1 -8.65 0.57 1
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231099 87572637 1 PN4C26H56 AB4C26D56 -37.64 3.19 0.0 0.0 0
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231100 87572641 2 FNO5C12H16 ABC5D12E16 -481.46 5.2 -9.01 -0.38 0
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231101 87572642 1 ClIO2N3H13C14 ABC2D3E13F14 36.5 4.5 -8.88 -1.9 0
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231102 87572643 2 PC2O4H6 AB2C4D6 -498.18 5.13 -10.53 -0.13 0
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231104 87572647 1 N2O10C25H36 A2B10C25D36 -405.9 4.4 -8.47 -0.18 0
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231105 87572648 1 NOH13C19 ABC13D19 31.99 3.79 -8.85 -0.81 0
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231108 87572652 1 BPF4C20H44 ABC4D20E44 -432.25 23.77 -10.68 -0.22 0
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231109 87572655 1 ClO2N9C26H32 AB2C9D26E32 23.31 9.9 -9.24 -0.96 0
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231110 87572659 1 BPF4C25H54 ABC4D25E54 -461.97 22.72 -10.94 -0.17 0
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231111 87572662 1 FN2O10C25H35 AB2C10D25E35 -455.77 4.98 -8.95 -0.1 0
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231112 87572663 1 FON2H13C17 ABC2D13E17 39.23 2.34 -9.44 -1.1 0
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231113 87572670 1 ClO2N8C23H29 AB2C8D23E29 9.48 11.86 -9.24 -0.96 0
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231114 87572680 1 N2O3C23H36 A2B3C23D36 -131.62 2.44 -9.26 0.57 0
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231116 87572684 1 SO2N4C17H18 AB2C4D17E18 19.97 6.41 -8.81 -0.7 0