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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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180505 76645185 1 PSN7O8C46H56 ABC7D8E46F56 -272.66 7.91 -8.5 -0.74 0
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180506 76646175 2 C7H11 A7B11 88.61 3.01 -8.39 -0.46 -1
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180507 76646309 1 YN4C8H13 AB4C8D13 101.72 5.73 -5.34 -0.59 1
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180508 76647006 1 ClFSO3N4C26H29 ABCD3E4F26G29 -141.73 4.93 0.0 0.0 1
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180509 76647012 1 FSO2N4C17H22 ABC2D4E17F22 -104.22 1.54 0.0 0.0 1
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180510 76647013 1 FSO4N6C23H28 ABC4D6E23F28 -150.95 5.47 0.0 0.0 0
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180511 76647014 1 FSO3N4C29H35 ABC3D4E29F35 -161.26 6.69 -8.48 -0.6 1
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180512 76647015 1 FS2N4O5C28H34 AB2C4D5E28F34 -194.73 4.43 0.0 0.0 0
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180513 76647866 1 NOC33H37 ABC33D37 -8.53 3.56 -8.22 -1.14 0
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180514 76647867 1 NOTiCl2C16H17 ABCD2E16F17 -106.49 13.74 -7.3 -2.08 0
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180515 76647868 1 NOC16H17 ABC16D17 4.93 3.46 -8.29 -1.06 0
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180516 76647869 1 NOTiCl2C16H23 ABCD2E16F23 -113.21 2.75 -8.4 -1.55 0
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180517 76647883 1 NOC19H21 ABC19D21 -4.13 3.16 -8.12 -1.01 0
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180518 76647917 1 NOC24H31 ABC24D31 -30.94 5.79 -7.97 -0.57 0
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180519 76647944 1 NOTiCl2H19C21 ABCD2E19F21 -46.0 6.52 -8.44 -1.61 0
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180520 76647945 1 NOH19C21 ABC19D21 28.63 3.38 -8.08 -1.1 -1
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180522 76648563 1 BNPtSO2H23C30 ABCDE2F23G30 201.57 7.56 0.0 0.0 -1
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180523 76648567 1 PtN3O4H26C29 AB3C4D26E29 102.2 4.1 0.0 0.0 0
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180524 76648628 1 PtO2N4C28H30 AB2C4D28E30 257.28 1.15 -8.22 -1.17 -1
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180525 76648727 1 IrN2O2C29H29 AB2C2D29E29 131.42 23.81 -9.28 -4.44 0
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180526 76648916 1 Si2N5O6C23H43 A2B5C6D23E43 -376.91 4.75 -8.87 -0.1 0
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180527 76648996 1 OC11H22 AB11C22 -85.09 1.97 -9.62 1.34 0
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180528 76649072 1 INO3C15H18 ABC3D15E18 -96.29 5.35 -9.54 -1.05 0
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180529 76649073 1 NSO3C13H17 ABC3D13E17 -105.27 4.02 -9.28 -0.51 0
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180530 76649074 1 N2O3C16H18 A2B3C16D18 -82.19 4.6 -10.06 -0.83 0
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180531 76649075 1 NO3C19H21 AB3C19D21 -96.96 2.36 -8.99 -0.57 1
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180532 76649454 1 ClN2C40H42 AB2C40D42 81.37 4.83 0.0 0.0 0
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180533 76649633 1 O2N3C11H19 A2B3C11D19 -113.28 4.63 -9.68 0.41 0
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180534 76649634 1 O3N4C23H34 A3B4C23D34 -127.26 4.26 -8.64 0.3 0
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180535 76649635 1 FN4O4C23H33 AB4C4D23E33 -204.02 5.37 -8.61 0.08 0
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180536 76649647 1 F2O3N4C22H30 A2B3C4D22E30 -210.77 4.5 -8.89 0.05 0
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180537 76649648 1 O2N3C10H11 A2B3C10D11 -62.17 5.18 -9.3 -0.22 -1
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180538 76650429 1 OSYC27H35 ABCD27E35 137.26 43.82 -5.03 -2.92 -1
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180539 76650495 1 ClYO2C24H30 ABC2D24E30 -58.52 2.14 -4.92 -0.5 -1
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180540 76650633 1 ClYC23H28 ABC23D28 -44.9 3.7 -6.32 -0.3 1
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180541 76650861 1 O3N7C16H20 A3B7C16D20 48.94 5.3 0.0 0.0 0
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180542 76651049 1 FO2C11H11 AB2C11D11 -103.88 1.43 -10.02 -0.74 1
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180544 76651051 1 NC29H36 AB29C36 129.43 1.7 0.0 0.0 0
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180545 76651351 1 FN2O2H13C16 AB2C2D13E16 -34.31 2.61 -8.98 -1.19 0
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180546 76651353 1 FN2O6H21C26 AB2C6D21E26 -178.26 1.11 -9.07 -1.12 0
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180547 76651354 1 BrFN3O5H17C24 ABC3D5E17F24 -122.1 7.17 -8.76 -1.13 0
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180548 76651534 1 N2O3H20C26 A2B3C20D26 22.65 4.22 -8.91 -1.18 0
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180549 76651591 1 SiN3O5C48H69 AB3C5D48E69 -234.25 7.62 -8.15 -0.17 -1
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180550 76651807 1 NOWC11H18 ABCD11E18 95.23 1.8 0.0 0.0 0
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180551 76652088 2 NO2F3C12H12 AB2C3D12E12 -470.34 8.3 -8.8 -0.5 0
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180552 76652483 1 ClSiN2S2O6C28H33 ABC2D2E6F28G33 -226.61 7.29 -9.11 -1.65 0
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180553 76652789 1 F3N4O4C24H35 A3B4C4D24E35 -346.73 3.25 -8.88 -0.7 0
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180554 76653243 1 FINO13C39H39 ABCD13E39F39 -515.55 7.63 -8.72 -0.65 0
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180555 76653244 1 FNSiO9C36H40 ABCD9E36F40 -351.34 3.76 -8.5 -0.42 0
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180556 76653245 1 FINSiO4C32H37 ABCDE4F32G37 -204.17 7.04 -8.68 -0.62 0