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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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133611 51562347 1 ClFNOC16H19 ABCDE16F19 -78.01 4.6 -8.85 -0.37 0
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133612 51562348 1 ClFNOC16H19 ABCDE16F19 -77.88 4.37 -8.86 -0.38 -1
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133613 51562479 1 PO3N4C9H10 AB3C4D9E10 -61.45 5.47 0.0 0.0 -1
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133614 51562583 1 N2O4C18H25 A2B4C18D25 -135.46 3.87 0.0 0.0 0
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133615 51562827 1 ClSO3N6H17C18 ABC3D6E17F18 56.72 9.23 -9.77 -1.75 1
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133616 51563415 1 F2N3O5C16H24 A2B3C5D16E24 -279.37 2.82 0.0 0.0 1
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133617 51563847 1 O2N4C23H31 A2B4C23D31 -51.63 5.49 0.0 0.0 1
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133618 51563848 1 O2N3C21H28 A2B3C21D28 -40.97 3.44 0.0 0.0 1
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133619 51563849 1 OSN3C22H30 ABC3D22E30 -15.93 4.49 0.0 0.0 0
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133620 51563850 1 OSN3C22H29 ABC3D22E29 -11.03 6.21 -8.64 -0.36 1
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133621 51563851 1 OSN3C22H30 ABC3D22E30 -9.93 5.47 0.0 0.0 1
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133622 51563913 1 O2N4C21H25 A2B4C21D25 -23.36 6.1 0.0 0.0 0
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133623 51564133 1 FSN2O3C18H25 ABC2D3E18F25 -167.11 5.26 -9.33 -0.76 0
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133624 51564195 1 O2N3C23H25 A2B3C23D25 -52.09 3.69 -8.57 -0.56 1
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133625 51564796 1 Br2N2O2C16H25 A2B2C2D16E25 -49.44 12.89 0.0 0.0 -1
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133626 51564868 1 BrN2O5H14C19 AB2C5D14E19 -114.75 2.87 0.0 0.0 0
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133627 51564889 2 SO2N3C9H12 AB2C3D9E12 -140.41 3.95 -8.78 -0.36 -1
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133628 51564943 1 SN3O3H16C17 AB3C3D16E17 -32.5 4.63 0.0 0.0 0
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133629 51565158 3 NOC8H11 ABC8D11 -135.03 3.4 -9.37 -0.15 1
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133630 51565579 1 FN2O4C23H30 AB2C4D23E30 -152.46 2.35 0.0 0.0 0
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133631 51566132 1 O2S2N3C20H21 A2B2C3D20E21 -16.77 3.4 -8.58 -1.42 0
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133632 51566140 1 O2S2N3C16H21 A2B2C3D16E21 -54.71 4.46 -8.98 -1.16 1
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133633 51566627 1 SO2N3C17H26 AB2C3D17E26 -66.3 16.56 0.0 0.0 0
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133634 51567091 1 S2N3O5H17C19 A2B3C5D17E19 -57.32 5.79 -9.59 -1.59 -1
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133635 51567176 1 ClFNSO4C12H14 ABCDE4F12G14 -197.29 3.15 0.0 0.0 -1