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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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183315 77006034 1 BrClN2O3H10C12 ABC2D3E10F12 -97.0 4.55 -10.12 -1.16 0
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183316 77006035 1 BrN2O5C13H13 AB2C5D13E13 -178.68 5.73 -10.01 -1.3 0
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183317 77006090 1 BrF2N2O2H9C11 AB2C2D2E9F11 -154.81 3.03 -10.27 -1.24 0
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183318 77006668 1 ClON5C12H18 ABC5D12E18 15.34 0.6 -8.98 -0.16 0
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183319 77006669 1 BrON5C12H18 ABC5D12E18 27.7 0.31 -8.93 -0.21 0
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183320 77006816 1 NSO3C16H19 ABC3D16E19 -103.79 3.34 -9.35 -0.5 0
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183321 77006817 1 NS2O3C14H17 AB2C3D14E17 -99.73 3.44 -9.14 -1.07 0
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183322 77007453 1 N3O6C7H9 A3B6C7D9 -170.99 5.88 -10.77 -1.0 1
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183323 77007454 1 N3O6C10H12 A3B6C10D12 -143.59 7.7 0.0 0.0 0
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183324 77007494 1 SO4N6C7H8 AB4C6D7E8 -33.91 5.78 -9.68 -1.18 0
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183325 77007763 1 NSO4C14H17 ABC4D14E17 -105.2 8.52 -9.49 -1.45 0
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183326 77007884 1 SN2O4C14H18 AB2C4D14E18 -148.8 5.45 -9.65 -1.46 0
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183327 77008132 2 NOC7H9 ABC7D9 -30.5 3.97 -8.38 -0.66 0
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183328 77008456 1 O2N3H13C14 A2B3C13D14 21.88 2.72 -8.73 -0.87 0
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183329 77008457 1 N3O3H13C14 A3B3C13D14 -12.35 2.94 -8.88 -0.86 0
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183330 77008882 1 O2N3C16H19 A2B3C16D19 -48.66 3.63 -9.56 -1.0 0
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183331 77008944 1 O2N3C9H13 A2B3C9D13 -53.28 4.17 -9.74 -0.65 0
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183332 77009242 1 N2O2S2C15H20 A2B2C2D15E20 -49.89 5.86 -8.89 -1.55 0
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183333 77009250 1 N2O2S2C13H16 A2B2C2D13E16 -30.0 3.68 -9.16 -1.97 0
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183334 77009543 1 N3O3C14H27 A3B3C14D27 -126.4 2.68 -9.35 0.34 0
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183335 77009544 1 O2N3C14H29 A2B3C14D29 -100.19 2.18 -9.27 0.62 0
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183336 77009708 1 O2N4H12C13 A2B4C12D13 38.25 2.87 -8.53 -1.23 0
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183337 77009759 1 N2F3O3C11H11 A2B3C3D11E11 -210.19 2.57 -8.42 -1.12 0
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183338 77009760 1 O2N3C15H15 A2B3C15D15 16.74 5.05 -8.76 -0.85 0
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183339 77009844 1 FO2N3H10C13 AB2C3D10E13 -12.14 5.07 -8.82 -1.09 0