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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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403363 135059867 1 O3F4C6H6 A3B4C6D6 -313.26 1.78 -11.16 -1.26 0
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403364 135059868 1 NSiC15H17 ABC15D17 37.9 3.28 -9.3 0.07 0
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403365 135059871 1 NOC9H11 ABC9D11 17.83 3.04 -8.6 -0.27 0
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403366 135059872 1 LiNOC9H10 ABCD9E10 -8.04 5.22 -7.71 0.39 0
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403367 135059879 1 IN2O2H13C15 AB2C2D13E15 -17.23 2.74 -8.92 -1.25 0
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403368 135059887 1 N2O5C26H28 A2B5C26D28 -121.71 7.18 -8.55 -0.76 0
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403369 135059889 1 N3C16H19 A3B16C19 33.43 3.12 -8.18 -0.16 0
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403370 135059896 2 NOC11H14 ABC11D14 -78.97 0.57 -8.73 -0.71 0
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403371 135059900 1 ON3H11C13 AB3C11D13 15.05 4.7 -8.36 -0.64 0
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403372 135059902 1 NSO2C15H17 ABC2D15E17 -52.94 1.7 -8.62 -0.17 0
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403373 135059907 1 ClIN2O2H20C27 ABC2D2E20F27 24.92 2.28 -8.86 -1.04 0
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403374 135059916 2 NO2C12H12 AB2C12D12 -86.46 3.67 -8.21 -0.89 0
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403375 135059919 1 ClON2H13C19 ABC2D13E19 54.27 3.47 -8.84 -1.37 1
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403376 135059923 1 N2O2S2C12H13 A2B2C2D12E13 40.35 7.86 0.0 0.0 0
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403377 135059926 1 FC7H11 AB7C11 -56.68 2.14 -9.63 1.08 0
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403378 135059927 1 ClNOC10H14 ABCD10E14 -41.79 3.93 -9.02 0.04 0
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403379 135059938 1 ON2C13H14 AB2C13D14 5.78 4.24 -8.9 -0.46 0
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403380 135059941 1 SeC10H19 AB10C19 -12.14 1.91 0.0 0.0 0
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403381 135059948 1 N3C31H31 A3B31C31 94.36 2.3 -8.0 -0.4 0
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403382 135059953 1 N3O3H25C31 A3B3C25D31 18.07 5.7 -8.36 -0.97 0
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403383 135059954 1 SN3O4H13C18 AB3C4D13E18 12.73 12.1 -9.26 -1.32 0
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403384 135059958 1 ON2H20C26 AB2C20D26 82.15 3.12 -8.38 -0.78 0
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403385 135059959 1 N2O3H20C21 A2B3C20D21 21.29 7.46 -9.36 -1.17 0
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403386 135059963 1 ClFIN2O4H23C29 ABCD2E4F23G29 -107.39 2.68 -8.52 -1.07 0
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403387 135059967 1 ON2H14C21 AB2C14D21 61.6 4.15 -8.02 -1.03 0
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403388 135059973 1 ClN2O2H13C19 AB2C2D13E19 -7.33 5.89 -9.12 -1.26 0
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403389 135060008 1 SN2O2C17H18 AB2C2D17E18 -31.86 1.42 -8.48 -0.97 0
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403390 135060010 1 FN2O2H19C25 AB2C2D19E25 -12.38 1.93 -8.3 -0.78 0
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403391 135060011 1 ON2H18C25 AB2C18D25 83.82 3.8 -8.57 -0.85 0
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403392 135060033 1 NO2S2C17H19 AB2C2D17E19 -27.33 5.63 -8.59 -0.58 0
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403393 135060034 2 OC4H7 AB4C7 -81.93 2.19 -9.87 0.48 0
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403394 135060037 2 OC7H8 AB7C8 -68.19 5.16 -9.65 -0.03 0
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403395 135060041 1 O3C14H28 A3B14C28 -125.71 2.95 -8.97 0.42 0
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403396 135060046 1 NOC14H21 ABC14D21 -40.72 2.73 -7.97 0.53 0
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403397 135060048 1 Cl2O3C8H10 A2B3C8D10 -130.85 5.55 -10.29 -0.73 0
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403398 135060052 1 AlLiOC11H26 ABCD11E26 -90.49 13.03 -8.02 1.7 0
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403399 135060054 1 SO2N3H17C25 AB2C3D17E25 59.76 6.42 -8.25 -1.02 0
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403400 135060068 1 ON2H16C20 AB2C16D20 50.2 3.98 -8.57 -0.68 0
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403401 135060069 1 N2O2C17H18 A2B2C17D18 -51.64 2.55 -8.85 -0.57 0
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403402 135060074 1 S2O4C17H24 A2B4C17D24 -171.11 2.52 -9.19 -0.3 0
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403403 135060086 1 Cl2N2C9H12 A2B2C9D12 4.87 4.02 -10.36 -1.0 0
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403404 135060089 1 NOSe2C12H13 ABC2D12E13 3.96 4.57 -8.09 -1.36 0
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403405 135060108 1 N2O3C19H24 A2B3C19D24 -69.2 2.99 -8.85 -0.37 0
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403406 135060111 1 N2O2C17H18 A2B2C17D18 -26.71 0.99 -8.28 -0.56 0
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403407 135060113 1 FN2H11C17 AB2C11D17 46.51 2.6 -8.55 -0.74 0
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403408 135060117 1 N2O2C19H20 A2B2C19D20 -31.71 3.46 -8.72 -0.61 0
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403409 135060120 1 SN2H16C19 AB2C16D19 89.05 2.21 -8.43 -0.72 0
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403410 135060126 1 N3O4H13C19 A3B4C13D19 -0.45 5.42 -9.11 -1.23 0
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403411 135060127 1 N2O3H12C17 A2B3C12D17 -25.24 3.63 -8.87 -1.26 0
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403412 135060133 1 N2O2H10C13 A2B2C10D13 -17.91 2.22 -8.81 -1.12 0