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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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135637 51907472 1 FN3O5C20H22 AB3C5D20E22 -180.96 6.21 -9.33 -0.42 0
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135638 51907473 1 SN2O4C24H32 AB2C4D24E32 -146.16 5.7 -9.19 -0.36 0
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135639 51907474 1 SN2O4C24H32 AB2C4D24E32 -147.55 9.7 -8.6 -0.7 0
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135640 51907591 1 SN6C18H18 AB6C18D18 150.68 6.06 -9.14 -0.88 0
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135641 51907883 1 INO3C13H14 ABC3D13E14 -76.06 2.34 -9.9 -1.32 0
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135642 51907916 1 BrNO4C16H16 ABC4D16E16 -108.42 4.95 -9.41 -1.19 0
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135643 51908564 1 ClSO3N4C22H27 ABC3D4E22F27 -54.18 3.62 -9.15 -0.68 0
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135644 51908629 1 SN3O8C18H23 AB3C8D18E23 -251.64 9.02 -10.38 -1.82 0
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135645 51908952 1 O2N4C21H32 A2B4C21D32 -46.06 4.25 -8.43 0.51 0
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135646 51908953 1 S2N3O5C20H25 A2B3C5D20E25 -177.0 2.46 -8.8 -0.4 0
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135647 51908954 1 SN2O3C20H22 AB2C3D20E22 -87.11 6.41 -8.96 -0.61 0
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135648 51909601 1 Cl2N2O7C22H24 A2B2C7D22E24 -296.31 6.89 -9.48 -0.99 0
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135649 51909893 1 FO2N3C21H28 AB2C3D21E28 -88.02 0.74 -8.57 -0.05 1
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135650 51909894 1 ClOSN3C21H27 ABCD3E21F27 16.14 2.53 0.0 0.0 1
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135651 51909895 1 ON4C27H33 AB4C27D33 38.66 6.59 0.0 0.0 0
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135652 51910279 1 F3O3N4C22H25 A3B3C4D22E25 -207.59 7.24 -8.14 -0.58 0
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135653 51910346 1 SO2N4C19H22 AB2C4D19E22 -6.81 2.54 -9.01 -1.1 0
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135654 51910347 1 SO2N4C19H22 AB2C4D19E22 -4.7 7.06 -9.04 -1.14 0
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135655 51911157 1 FOSN5C21H32 ABCD5E21F32 -54.65 3.84 -9.01 -0.52 1
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135656 51911180 1 ClSO2N5C20H31 ABC2D5E20F31 -24.41 6.84 0.0 0.0 0
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135657 51911570 1 SN2O5C22H26 AB2C5D22E26 -166.61 2.77 -9.88 -1.59 0
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135658 51911669 2 N2O2C11H11 A2B2C11D11 -83.51 6.05 -9.03 -0.98 0
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135659 51911706 1 N3O5C28H31 A3B5C28D31 -156.63 1.79 -8.14 -0.71 0
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135660 51911832 1 Cl3N3O3H16C19 A3B3C3D16E19 -102.84 1.73 -9.71 -0.92 0
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135661 51911967 1 NSO5C21H29 ABC5D21E29 -210.34 3.81 -9.68 -1.09 0