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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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231765 87574617 1 ClFSO3C10H10 ABCD3E10F10 -131.76 4.27 -9.28 -1.05 1
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231766 87574619 1 N2O2C5H13 A2B2C5D13 0.97 13.95 0.0 0.0 0
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231767 87574620 1 NOC15H27 ABC15D27 -67.18 2.49 -9.3 -0.26 0
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231768 87574621 1 S2N5O5H21C26 A2B5C5D21E26 -35.15 7.78 -9.03 -1.31 0
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231769 87574625 1 SiO4C12H22 AB4C12D22 -243.85 5.25 -9.87 -0.31 0
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231770 87574629 1 SO6C21H32 AB6C21D32 -259.08 5.5 -9.08 0.12 0
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231771 87574632 1 S3N9O9H43C51 A3B9C9D43E51 -128.37 10.27 -9.29 -1.68 0
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231772 87574633 1 SiO3H15C16F22 AB3C15D16E22 -1300.25 0.2 0.0 0.0 0
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231773 87574640 1 NO4C6H9 AB4C6D9 -157.7 3.85 -10.54 -0.29 0
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231774 87574641 1 ON2F6H14C15 AB2C6D14E15 -287.97 3.8 -9.33 -0.59 0
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231775 87574642 1 SiN3O6C25H35 AB3C6D25E35 -163.57 3.23 -8.81 -0.81 0
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231776 87574643 1 NSO7C29H37 ABC7D29E37 -289.29 4.23 -9.43 -0.03 0
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231777 87574644 1 BrSO2N4H9C14 ABC2D4E9F14 38.21 6.16 -9.34 -2.27 -1
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231778 87574645 1 N2O4C9H19 A2B4C9D19 -153.51 13.88 0.0 0.0 0
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231779 87574646 1 NSO5F6H15C16 ABC5D6E15F16 -489.18 7.55 -9.52 -1.96 0
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231780 87574647 1 N2O2C27H28 A2B2C27D28 -7.14 3.54 -8.69 -0.15 0
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231781 87574649 1 ON2C11H12 AB2C11D12 17.87 5.66 -8.45 -0.07 0
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231782 87574650 1 NC7H9 AB7C9 99.31 1.98 -9.36 0.75 0
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231783 87574651 2 NO2C8H10 AB2C8D10 -97.86 2.91 -8.15 -0.18 0
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231784 87574652 1 ClFSO3C10H10 ABCD3E10F10 -135.33 8.92 -9.48 -0.85 0
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231785 87574653 2 NO2C8H10 AB2C8D10 -53.1 4.43 -8.3 -0.24 0
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231786 87574654 1 ClFIN3O3H8C12 ABCD3E3F8G12 -24.37 4.67 -9.37 -1.58 0
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231787 87574655 1 NPtO2C6H17 ABC2D6E17 -81.55 3.48 -8.96 0.27 0
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231788 87574661 2 N3O4C20H29 A3B4C20D29 -360.18 2.18 -8.94 -0.5 0
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231789 87574667 1 CSbH3Cl4 ABC3D4 -74.39 3.79 -11.99 -2.49 0
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231790 87574669 1 NSO5C26H31 ABC5D26E31 -194.12 1.99 -9.59 -0.03 0
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231791 87574670 1 PtO4C10H14 AB4C10D14 -42.83 2.15 -10.08 -3.27 0
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231792 87574671 1 OSN7C27H31 ABC7D27E31 81.45 7.81 -8.55 -0.98 0
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231793 87574673 2 NSC6H10 ABC6D10 7.27 2.03 -7.81 -0.33 0
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231794 87574675 1 Si2O3C25H28 A2B3C25D28 -156.71 5.86 -9.3 -0.16 0
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231795 87574676 1 N3C11H17 A3B11C17 30.75 2.58 -8.83 -0.25 0
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231796 87574677 1 Si2O3C28H32 A2B3C28D32 -117.63 5.45 -8.1 -0.24 0
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231797 87574678 1 Si2O3C25H25 A2B3C25D25 -50.48 5.26 0.0 0.0 0
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231798 87574679 1 O2F3N5H18C21 A2B3C5D18E21 -111.87 2.87 -8.69 -1.19 0
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231799 87574680 1 NO4C21H23 AB4C21D23 -118.31 4.25 -9.44 -1.06 0
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231800 87574681 1 NO4C21H23 AB4C21D23 -118.99 3.61 -9.34 -0.78 0
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231801 87574682 1 ClSO4N5C23H26 ABC4D5E23F26 -98.61 1.7 -8.62 -0.92 0
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231802 87574683 1 BrMgOC13H19 ABCD13E19 -68.72 3.57 -9.17 -0.09 0
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231803 87574686 1 ClNO4C18H22 ABC4D18E22 -161.46 5.53 -10.05 -1.56 0
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231804 87574688 1 SN2O9C16H18 AB2C9D16E18 -350.1 6.6 -10.71 -1.79 0
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231805 87574689 1 OSN7C26H29 ABC7D26E29 84.49 4.87 -8.55 -1.04 0
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231806 87574693 1 SN3O5C6H13 AB3C5D6E13 -218.24 6.33 -10.18 -0.23 0
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231807 87574695 1 ClO2N4H13C18 AB2C4D13E18 37.41 4.1 -9.19 -1.13 1
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231808 87574696 1 BNO2C5H14 ABC2D5E14 -125.32 6.96 -7.58 1.12 1
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231809 87574697 1 BNO2C5H14 ABC2D5E14 -105.56 7.82 -8.22 0.54 0
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231810 87574699 1 ClFSO2C12H12 ABCD2E12F12 -81.22 6.11 -9.84 -1.08 0
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231811 87574705 1 NO3F6H7C11 AB3C6D7E11 -389.1 5.29 -10.67 -1.91 0
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231812 87574706 1 O3C11H16 A3B11C16 -106.67 3.68 -10.03 0.71 0
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231813 87574708 1 NSO5C19H21 ABC5D19E21 -169.96 2.98 -9.62 -0.36 0
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231814 87574710 1 SnS6C12H23 AB6C12D23 -9.35 1.76 0.0 0.0 0