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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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225386 85756603 1 O5C22H22 A5B22C22 -131.25 2.37 -8.51 -0.52 0
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225387 85756605 1 Si2F5C11H13 A2B5C11D13 -265.37 3.7 -9.27 -0.77 0
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225388 85756638 1 NF2O2H15C21 AB2C2D15E21 -93.71 4.54 -8.53 -0.66 0
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225389 85756639 1 NF2O3H17C23 AB2C3D17E23 -137.39 2.17 -9.65 -1.28 0
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225390 85756641 1 ClOF2H13C17 ABC2D13E17 -93.66 2.65 -9.57 -0.58 0
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225391 85756643 1 NO4H19C23 AB4C19D23 -87.5 2.98 -9.28 -1.05 0
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225392 85756646 1 ClNO4H14C18 ABC4D14E18 -70.9 5.16 -8.77 -1.19 0
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225393 85756648 1 ClNO4H14C18 ABC4D14E18 -72.98 4.02 -8.82 -1.25 0
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225394 85756657 1 F2O3H20C24 A2B3C20D24 -142.68 2.6 -9.43 -0.52 0
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225395 85756663 1 SSiO3C13H22 ABC3D13E22 -225.05 4.81 -8.08 0.66 0
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225396 85756672 1 O4C15H20 A4B15C20 -170.28 4.86 -8.98 -0.27 1
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225397 85756679 1 TeC12H15 AB12C15 48.1 1.13 0.0 0.0 0
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225398 85756687 1 O4C19H28 A4B19C28 -200.91 3.96 -9.6 -0.56 0
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225399 85756688 2 O3C5H8 A3B5C8 -265.72 6.42 -10.47 -0.36 0
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225400 85756690 1 NO3H17C18 AB3C17D18 -17.03 2.04 -8.88 -0.19 0
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225401 85756693 1 SO4C12H16 AB4C12D16 -168.04 12.07 -10.24 -1.0 0
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225402 85756696 1 SO4C14H20 AB4C14D20 -176.13 11.07 -10.36 -0.96 0
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225403 85756728 4 OC12H15 AB12C15 -149.95 1.9 -8.5 -0.8 0
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225404 85756732 1 O2F3H3N4C6 A2B3C3D4E6 -146.26 5.15 -10.45 -2.29 0
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225405 85756743 2 O2C11H11 A2B11C11 -105.47 4.72 -9.22 -0.68 0
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225406 85756754 1 SO2C14H20 AB2C14D20 -88.88 1.63 -8.45 0.09 0
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225407 85756763 1 OSiC12H20 ABC12D20 -61.91 1.84 -9.14 0.54 0
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225408 85756764 2 SiC10H19 AB10C19 -85.15 1.01 -8.16 0.73 0
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225409 85756766 1 ClNO5C18H18 ABC5D18E18 -120.64 0.61 -9.04 -1.79 0
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225410 85756780 2 NO2C7H11 AB2C7D11 -170.89 4.63 -9.43 -0.65 0
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225411 85756790 1 NF5O5C14H14 AB5C5D14E14 -431.16 5.69 -9.64 -0.72 0
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225412 85756792 1 ClO6H13C20 AB6C13D20 24.84 11.52 -9.17 -2.14 1
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225413 85756793 1 O2H13C20 A2B13C20 14.86 2.7 0.0 0.0 0
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225414 85756794 1 ClNO2C12H14 ABC2D12E14 -76.32 2.11 -9.45 -0.24 0
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225415 85756797 2 H3O3C5 A3B3C5 -210.82 3.69 -10.59 -1.81 0
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225416 85756805 1 C35H46 A35B46 -8.84 0.57 -8.58 -0.39 0
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225417 85756825 1 NO3C20H25 AB3C20D25 -31.32 3.42 -9.34 -0.46 0
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225418 85756826 1 NO2C13H17 AB2C13D17 7.04 4.18 -9.42 -0.49 0
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225419 85756830 1 NO3H13C14 AB3C13D14 -65.83 8.71 -9.35 -1.08 0
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225420 85756831 1 N2S2O3C9H16 A2B2C3D9E16 -115.06 4.6 -9.02 -0.17 0
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225421 85756838 1 OC16H20 AB16C20 -31.07 3.12 -9.28 -0.39 0
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225422 85756857 1 NOC18H23 ABC18D23 -7.24 3.0 -8.36 -0.37 0
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225423 85756859 1 O2C13H26 A2B13C26 -98.63 1.99 -9.42 1.4 0
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225424 85786730 1 SO3N4C11H18 AB3C4D11E18 -79.5 9.38 -9.54 -0.75 0
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225425 85786779 2 NOH9C10 ABC9D10 -2.39 2.98 -8.91 -0.98 0
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225426 85786784 1 ClNO2H14C16 ABC2D14E16 -39.74 6.05 -9.02 -1.42 0
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225427 85786785 1 OC13H14 AB13C14 -8.86 3.9 -9.48 0.26 0
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225428 85786790 1 O2Cl3C20H23 A2B3C20D23 -80.91 4.34 -8.81 -0.3 0
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225429 85786796 1 ON3C30H43 AB3C30D43 -1.6 11.25 -8.78 -1.28 0
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225430 85786802 2 NH10C13 AB10C13 143.5 3.25 -8.94 -0.63 0
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225431 85786805 1 NO2C20H31 AB2C20D31 -50.65 2.8 -8.88 0.44 0
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225432 85786820 1 NS2C16H17 AB2C16D17 55.27 3.6 -8.6 -0.49 0
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225433 85786821 1 NS2C11H13 AB2C11D13 55.91 3.24 -8.66 -0.47 0
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225434 85786826 1 PSO3C6H13 ABC3D6E13 -195.86 3.44 -9.18 -0.03 0
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225435 85786827 1 NS2C20H23 AB2C20D23 47.42 4.21 -8.45 -0.31 0