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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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150934 53790631 2 C4H5 A4B5 97.3 1.13 -8.59 0.49 0
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150935 53790632 1 O2S2C35H50 A2B2C35D50 -86.98 4.27 -8.74 -1.23 0
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150936 53790633 1 O2S2C35H50 A2B2C35D50 -87.77 5.14 -8.73 -1.24 0
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150937 53790634 1 ClOH13C17 ABC13D17 41.09 2.73 -9.36 -0.02 0
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150938 53790635 2 OC7H7 AB7C7 -63.82 5.1 -9.14 -0.81 0
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150939 53790636 1 N2O7C27H30 A2B7C27D30 -176.24 4.8 -9.74 -1.26 0
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150940 53790637 1 N2O7C27H30 A2B7C27D30 -172.68 5.25 -9.67 -1.49 0
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150941 53790638 1 N2O7C27H30 A2B7C27D30 -172.34 4.45 -9.68 -1.56 0
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150942 53790639 1 O3C12H14 A3B12C14 -104.71 4.5 -9.07 -0.17 0
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150943 53790640 1 PN6O9C15H21 AB6C9D15E21 -393.05 4.83 -9.18 -0.62 0
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150944 53790641 1 O2F8H12C17 A2B8C12D17 -456.2 8.31 -10.06 -1.08 0
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150945 53790642 1 FNSO8C36H40 ABCD8E36F40 -222.54 8.77 -8.62 -1.48 0
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150946 53790643 1 O4C17H30 A4B17C30 -185.86 2.48 -9.78 0.31 0
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150947 53790644 1 IF4O4C23H35 AB4C4D23E35 -420.37 5.0 -9.6 -0.83 1
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150948 53790645 1 Cl2O3C5H9 A2B3C5D9 -132.42 5.05 0.0 0.0 0
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150949 53790646 1 Cl2O3C5H8 A2B3C5D8 -140.93 2.28 -10.19 -0.75 0
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150950 53790647 1 O4C9H14 A4B9C14 -125.96 2.38 -10.45 0.18 0
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150951 53790648 1 N3O7C30H51 A3B7C30D51 -341.26 2.56 -8.86 -0.22 0
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150952 53790649 1 ClN2O2F3H4C9 AB2C2D3E4F9 -201.4 5.68 -9.66 -1.48 0
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150953 53790650 1 Cl2O4C25H32 A2B4C25D32 -153.67 1.36 -8.03 -0.22 0
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150954 53790651 1 NSO3C11H15 ABC3D11E15 -103.53 7.06 -9.36 -0.44 0
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150955 53790652 1 SN2O2C11H14 AB2C2D11E14 -38.25 10.2 -8.9 -0.74 0
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150956 53790653 1 N2O3C20H20 A2B3C20D20 -17.92 4.5 -8.2 -0.77 0
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150957 53790654 1 NO3C21H43 AB3C21D43 -206.28 2.88 -9.86 0.75 0
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150958 53790655 1 ClON3C11H14 ABC3D11E14 -32.75 6.52 -8.64 -0.32 0