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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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69451 47177787 1 SO2N3C13H15 AB2C3D13E15 -14.22 6.9 -9.16 -0.1 0
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69452 47178491 1 SN3O3C13H13 AB3C3D13E13 -44.79 3.27 -9.0 -0.87 0
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69453 47178803 1 ClSN2O2C14H19 ABC2D2E14F19 -69.82 4.69 -9.32 -0.5 0
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69454 47178804 1 ClSN2O2C14H19 ABC2D2E14F19 -86.77 1.98 -9.44 -0.58 0
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69455 47179884 1 BrN2O2C15H21 AB2C2D15E21 -85.67 2.02 -9.44 -0.58 0
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69456 47179931 1 BrFON2H8C14 ABCD2E8F14 7.63 4.56 -9.55 -0.88 0
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69457 47180334 1 SO3N4H8C11 AB3C4D8E11 -27.53 4.3 -8.69 -1.72 0
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69458 47180337 1 ClO2N4C13H19 AB2C4D13E19 -78.48 2.66 -9.13 -0.67 0
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69459 47181118 1 OSN4C14H24 ABC4D14E24 -35.1 4.41 -9.09 -0.48 0
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69460 47183088 1 INOH16C17 ABCD16E17 16.93 4.99 -8.54 -1.18 0
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69461 47183209 1 ClFINOH12C15 ABCDEF12G15 -44.66 3.6 -9.07 -0.99 0
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69462 47183955 1 OSN3H13C14 ABC3D13E14 40.67 4.18 -9.14 -0.8 0
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69463 47184008 1 N3O3C13H13 A3B3C13D13 -93.5 9.52 -9.43 -1.11 0
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69464 47184032 1 ON3C12H15 AB3C12D15 -5.2 5.11 -9.12 -0.69 0
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69465 47184086 1 SN2O2C14H18 AB2C2D14E18 -44.73 4.16 -8.99 -0.31 0
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69466 47184467 1 OSBr2N2H8C10 ABC2D2E8F10 23.53 0.9 -9.4 -0.82 0
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69467 47185046 1 BrSN2H13C15 ABC2D13E15 78.49 3.49 -8.55 -0.67 0
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69468 47186438 1 ClON3C14H22 ABC3D14E22 -48.58 5.25 -8.6 -0.15 0
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69469 47186605 1 BrON2C15H23 ABC2D15E23 -57.21 3.01 -9.58 -0.44 0
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69470 47186798 1 SN3O3C13H15 AB3C3D13E15 -64.32 6.28 -9.18 -1.29 0
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69471 47188882 1 ClNOC17H22 ABCD17E22 -39.67 4.03 -9.61 -0.21 0
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69472 47189255 1 N3O3C13H17 A3B3C13D17 -129.61 2.28 -8.98 -0.28 0
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69473 47189463 2 NO2C7H9 AB2C7D9 -132.99 1.17 -9.03 0.0 0
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69474 47190238 1 SF3N3O3C10H14 AB3C3D3E10F14 -244.26 5.87 -9.71 -0.6 0
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69475 47190587 1 N2O2F3C13H13 A2B2C3D13E13 -197.72 3.92 -10.14 -0.96 0