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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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79503 49786890 1 O3N5H31C33 A3B5C31D33 1.98 1.21 -8.72 -1.34 0
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79504 49786901 1 ClSN2O4C20H21 ABC2D4E20F21 -126.87 6.98 -9.52 -0.85 0
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79505 49786926 1 SN3O5H21C23 AB3C5D21E23 -92.69 10.96 -8.62 -1.07 0
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79506 49786927 1 SN3O5C23H25 AB3C5D23E25 -97.34 10.07 -8.3 -0.83 0
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79507 49786933 1 ClSN2O5C23H23 ABC2D5E23F23 -145.61 6.59 -9.42 -0.44 0
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79508 49786940 1 SF3N3O5C20H20 AB3C3D5E20F20 -297.57 9.3 -10.1 -1.36 0
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79509 49786944 1 NO4C22H23 AB4C22D23 -115.83 3.21 -8.7 -0.86 0
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79510 49786946 1 SN2O3C18H28 AB2C3D18E28 -133.64 7.05 -9.32 -0.58 0
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79511 49786948 1 P3N15O23C39H50 A3B15C23D39E50 -1021.74 19.86 -9.33 -1.29 0
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79512 49786949 2 N6O7C28H40 A6B7C28D40 -457.12 15.12 -9.36 -1.92 0
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79513 49786950 1 C3O3H16 A3B3C16 -197.42 0.88 -10.72 2.34 0
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79514 49811844 1 SN3O3H21C23 AB3C3D21E23 -60.2 1.53 -8.99 -1.17 0
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79515 49815675 1 SO2N4C20H22 AB2C4D20E22 -44.27 3.06 -8.59 -0.67 0
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79516 49815676 1 SO2N4C20H22 AB2C4D20E22 -43.7 5.33 -8.86 -0.57 0
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79517 49815679 1 SO2N4C11H14 AB2C4D11E14 -62.67 5.41 -8.91 -0.61 0
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79518 49816669 1 ClO2N3H16C19 AB2C3D16E19 -24.77 1.33 -9.0 -1.23 0
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79519 49816670 1 ClN3O4H20C21 AB3C4D20E21 -111.89 3.72 -8.82 -1.06 0
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79520 49816673 1 Cl2N3O4H19C21 A2B3C4D19E21 -112.57 6.06 -8.32 -0.98 0
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79521 49816675 1 ClO2N3C23H24 AB2C3D23E24 -47.43 2.64 -9.34 -0.99 0
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79522 49816685 1 ClN3O4H18C21 AB3C4D18E21 -112.11 5.83 -9.31 -1.25 0
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79523 49816686 1 ClO2N3H20C21 AB2C3D20E21 -44.18 2.46 -8.74 -1.12 0
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79524 49816687 1 ClO2N3H20C21 AB2C3D20E21 -32.21 3.55 -9.61 -0.66 0
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79525 49816690 1 ClO2N3C17H20 AB2C3D17E20 -78.2 2.42 -9.66 -0.96 0
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79526 49816799 1 ClO2N3H20C21 AB2C3D20E21 -32.89 4.48 -9.28 -0.84 0
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79527 49816801 1 O2N3C24H27 A2B3C24D27 -40.5 4.48 -8.82 -0.55 0