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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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177505 76195245 1 ClN2O4C19H21 AB2C4D19E21 -90.13 5.88 -8.19 -0.67 0
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177506 76195304 1 BrClN2O4C21H24 ABC2D4E21F24 -95.54 4.86 -8.45 -0.68 0
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177507 76195361 1 O2N3C18H27 A2B3C18D27 -73.47 4.12 -9.23 0.25 0
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177508 76195435 1 N2O3C16H24 A2B3C16D24 -90.2 6.11 -9.05 -0.26 0
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177509 76195436 1 ClN2O2C16H23 AB2C2D16E23 -73.38 4.73 -9.15 -0.27 0
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177510 76195492 1 OSN2C12H18 ABC2D12E18 -8.17 5.69 -9.11 -0.75 0
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177511 76195493 1 ClN2O2C15H21 AB2C2D15E21 -62.33 4.11 -9.25 -0.44 0
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177512 76195619 1 ClN2O2H21C23 AB2C2D21E23 11.7 2.34 -9.17 -0.41 0
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177513 76195620 1 ON2H22C23 AB2C22D23 51.53 6.36 -9.07 -0.31 0
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177514 76195859 1 FN2O2H17C18 AB2C2D17E18 -87.57 1.21 -9.24 -0.63 0
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177515 76196040 1 BrN3O4C26H26 AB3C4D26E26 -58.94 13.36 -8.4 -1.43 0
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177516 76196041 1 BrN2O4C13H17 AB2C4D13E17 -104.21 8.28 -8.42 -1.48 0
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177517 76196160 1 Cl2N3O3H19C20 A2B3C3D19E20 -47.56 4.35 -9.02 -0.98 0
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177518 76196161 1 N2O3C22H26 A2B3C22D26 -35.05 5.4 -8.67 -0.33 0
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177519 76196409 1 CoN2O3H10C13 AB2C3D10E13 46.22 18.2 0.0 0.0 0
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177520 76196410 1 ON2C12H18 AB2C12D18 -9.08 4.62 -9.3 -1.22 2
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177521 76197104 1 ClZnN2O4C18H21 ABC2D4E18F21 -114.6 2.86 -8.52 -1.73 0
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177522 76197105 1 ClSN4H13C15 ABC4D13E15 99.31 1.65 -8.74 -0.92 0
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177523 76197106 1 S2O5N6C12H16 A2B5C6D12E16 14.2 6.9 -9.31 -2.01 5
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177524 76197451 1 Fe2C5H5O5P5F15 A2B5C5D5E5F15 -1461.84 1.63 0.0 0.0 0
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177525 76197524 1 ClN5C9H14 AB5C9D14 21.55 3.82 -8.47 -0.09 2
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177526 76197620 1 CuON3H15C17 ABC3D15E17 143.27 7.33 0.0 0.0 0
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177527 76197621 1 WN2O4C14H18 AB2C4D14E18 -18.45 4.31 -6.92 -0.25 0
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177532 76197888 1 CuNCl2O3C15H31 ABC2D3E15F31 -74.53 7.38 0.0 0.0 1
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177533 76198102 1 KSO6H8C9 ABC6D8E9 -240.3 12.13 0.0 0.0 0