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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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226541 87457851 2 O2H13C22 A2B13C22 21.14 0.58 -8.77 -1.64 0
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226542 87457853 1 FOCl2N4H9C12 ABC2D4E9F12 -33.42 4.44 -9.57 -1.09 0
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226544 87464910 1 SN3F4O4H17C21 AB3C4D4E17F21 -295.22 1.74 -8.82 -1.12 0
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226545 87464911 2 Cl3O3C13H14 A3B3C13D14 -254.79 3.29 -9.36 -1.41 0
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226546 87467690 1 SSiN2O2C9H12 ABC2D2E9F12 -47.6 1.2 -8.96 -0.77 0
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226548 87491659 2 N2C5H5 A2B5C5 193.71 0.84 -8.26 -0.87 -1
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226550 87493179 1 PCl3O3C17H26 AB3C3D17E26 -201.51 1.81 -9.29 -0.46 0
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226551 87494406 1 N2O4C21H24 A2B4C21D24 -139.45 3.83 -9.39 -0.86 -4
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226552 87521664 1 SiZrCl2H44C45 ABC2D44E45 33.17 4.66 -7.5 -1.03 0
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226553 87524789 1 FSO2N4H23C27 ABC2D4E23F27 29.23 18.6 -7.8 -2.12 0
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226554 87525615 1 S2N3O6C7H9 A2B3C6D7E9 -173.47 7.26 -9.66 -1.37 0
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226555 87525983 1 AsO4C18H19 AB4C18D19 -111.59 4.06 -9.49 -0.64 0
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226556 87529487 1 ClN2O3H19C22 AB2C3D19E22 -35.25 5.78 -9.56 -0.65 0
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226557 87533164 2 SC6H8 AB6C8 42.62 2.94 -8.23 -1.2 0
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226558 87544091 1 OBr2N3H7C9 AB2C3D7E9 33.96 3.4 -9.66 -1.38 0
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226559 87544094 2 N3O5C27H33 A3B5C27D33 -313.51 1.78 -9.34 -0.83 0
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226560 87544095 2 N3O5C27H32 A3B5C27D32 -301.65 6.36 -9.42 -0.77 0
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226561 87544097 1 BrN3O3C22H22 AB3C3D22E22 4.07 5.36 -9.14 -0.93 0
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226562 87544098 1 NO2C11H11 AB2C11D11 5.43 3.67 -8.36 -0.87 0
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226563 87544099 1 NO5C9H13 AB5C9D13 -215.25 5.71 -10.37 -0.29 0
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226564 87544101 1 SF3O4N5C28H28 AB3C4D5E28F28 -215.39 4.54 -8.65 -0.82 0
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226565 87544102 1 SN2O5C13H22 AB2C5D13E22 -211.67 5.94 -8.48 -0.06 0
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226566 87544103 1 SN2O5C13H22 AB2C5D13E22 -211.13 3.78 -8.46 -0.08 -1
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226567 87544104 1 F3N3O8H33C34 A3B3C8D33E34 -233.86 32.57 0.0 0.0 0
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226568 87544188 1 NSO4C12H13 ABC4D12E13 -113.78 6.35 -9.23 -0.9 0