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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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160574 57389092 1 S2O4N6C9H14 A2B4C6D9E14 -53.08 8.04 -9.46 -1.72 0
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160575 57389105 1 F3N3O4C27H28 A3B3C4D27E28 -275.88 1.34 -8.82 -0.96 0
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160576 57389108 1 F3N3O4C28H28 A3B3C4D28E28 -275.67 8.95 -9.42 -1.13 0
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160577 57389110 1 ClSN2O3H17C20 ABC2D3E17F20 -28.43 8.39 -9.44 -1.36 0
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160578 57389114 1 ClSO2N3C22H22 ABC2D3E22F22 3.15 4.5 -9.22 -1.14 0
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160581 57389121 1 ClON7H22C24 ABC7D22E24 113.89 5.99 -8.83 -1.0 0
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160582 57389125 1 F2N5O5C25H25 A2B5C5D25E25 -192.25 6.99 -9.62 -1.01 0
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160583 57389127 1 F3N5O5C26H28 A3B5C5D26E28 -305.29 6.45 -9.55 -1.26 0
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160584 57389131 1 SF3N3O3C19H22 AB3C3D3E19F22 -234.3 6.65 -9.49 -1.24 1
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160585 57389134 1 N6O6C40H45 A6B6C40D45 -152.02 14.28 0.0 0.0 1
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160586 57389136 1 SN5O6C39H44 AB5C6D39E44 -145.66 4.29 0.0 0.0 0
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160587 57389139 1 SN2O5C23H28 AB2C5D23E28 -185.52 6.48 -9.06 -0.99 0
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160588 57389140 1 SN2O5C23H28 AB2C5D23E28 -185.89 3.74 -9.02 -1.14 0
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160589 57389141 1 NSO5C24H29 ABC5D24E29 -195.68 8.62 -8.98 -0.69 0
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160590 57389144 1 OSN6C12H12 ABC6D12E12 43.5 3.66 -8.55 -0.9 0
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160591 57389147 1 OSN6C16H18 ABC6D16E18 45.74 3.95 -8.77 -1.19 0
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160592 57389148 1 OSN6C16H18 ABC6D16E18 40.39 3.61 -8.79 -1.22 0
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160593 57389154 1 O2N4C15H16 A2B4C15D16 -16.58 3.97 -8.73 -0.78 0
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160594 57389155 1 ON4H14C17 AB4C14D17 66.61 6.73 -9.26 -1.41 0
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160595 57389156 1 OSN3C15H15 ABC3D15E15 15.26 3.98 -8.45 -1.07 0
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160598 57389166 1 ClN2O4C13H13 AB2C4D13E13 -116.63 4.53 -10.34 -1.2 0
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160600 57389175 1 FON5H26C30 ABC5D26E30 53.47 5.28 -8.86 -0.6 0
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160601 57389176 1 ON4H20C26 AB4C20D26 105.61 2.39 -8.97 -1.14 0
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160602 57389177 1 O2N3H25C27 A2B3C25D27 25.23 5.77 -8.87 -0.72 0
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160603 57389182 1 SF3O3N6C7H7 AB3C3D6E7F7 -173.88 6.46 -10.14 -2.07 0
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160605 57389188 1 SF3O3N5H6C7 AB3C3D5E6F7 -185.17 5.56 -10.54 -2.0 0
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160608 57389194 1 F3O3N4C26H27 A3B3C4D26E27 -230.52 9.48 -9.45 -1.17 0
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160611 57389209 1 FON7H22C24 ABC7D22E24 77.05 5.45 -8.72 -1.04 0
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160614 57389216 1 FN5O5C24H28 AB5C5D24E28 -202.46 4.23 -9.23 -1.32 0
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160615 57389220 1 ClON3C19H24 ABC3D19E24 -24.16 3.5 -9.08 -0.98 0
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160617 57389228 1 O3N4C23H26 A3B4C23D26 -61.25 8.83 -9.39 -1.04 0
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160618 57389230 2 ON3C8H9 AB3C8D9 12.13 3.25 -9.15 -1.23 0
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160619 57389235 1 ON3C16H23 AB3C16D23 -46.85 4.92 -9.16 -0.52 0
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160621 57389237 2 ON2C8H11 AB2C8D11 -77.55 4.97 -9.41 -0.72 0
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160622 57389241 1 FON4H13C16 ABC4D13E16 -4.77 4.44 -9.49 -1.59 0
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160623 57389246 1 N2O6H18C19 A2B6C18D19 -158.83 2.03 -8.88 -1.07 0
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160624 57389250 1 SiO3C13H24 AB3C13D24 -134.01 1.21 -8.87 0.92 0
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160625 57389252 2 NO2C10H15 AB2C10D15 -88.41 12.84 -9.23 -2.19 0
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160626 57389255 1 NPO8C9H18 ABC8D9E18 -438.73 5.02 -10.38 0.41 0
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160627 57389258 1 ON4H22C26 AB4C22D26 101.54 4.06 -8.61 -0.58 0
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160628 57389260 1 FON7H24C27 ABC7D24E27 70.85 3.47 -8.68 -1.02 0
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160630 57389269 1 SF3O3N5C8H8 AB3C3D5E8F8 -198.69 6.84 -10.24 -1.83 0
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160631 57389273 1 SO3N6C9H10 AB3C6D9E10 29.25 8.01 -9.92 -1.67 0
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160634 57389282 1 F3N3O4C27H28 A3B3C4D27E28 -280.62 6.32 -9.18 -1.01 0
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160635 57389284 1 F3O3N4C28H31 A3B3C4D28E31 -248.69 3.71 -9.36 -0.78 0
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160636 57389285 1 FO2N6H23C25 AB2C6D23E25 -22.18 4.61 -9.52 -1.14 0
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160637 57389290 1 NSO3C5H9 ABC3D5E9 -118.23 4.49 -10.96 0.09 0
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160638 57389291 1 SN2O5C13H20 AB2C5D13E20 -174.93 5.55 -10.25 -0.1 0
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160639 57389292 1 SO11N12C40H62 AB11C12D40E62 -500.81 13.08 -9.02 -0.23 0
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160640 57389293 1 S2N9O9C34H53 A2B9C9D34E53 -413.75 5.2 -9.33 -0.2 0