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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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70477 48413402 1 O2S2N4C19H28 A2B2C4D19E28 -50.8 3.23 -8.46 -0.32 0
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70478 48413407 2 OSN2C9H13 ABC2D9E13 -45.98 4.41 -8.44 -0.32 0
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70479 48413408 1 S2O3N5C18H21 A2B3C5D18E21 -56.34 5.71 -8.4 -0.5 0
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70480 48413410 2 OSN2C9H13 ABC2D9E13 -48.79 4.24 -8.57 -0.43 0
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70481 48413412 2 OSN2C9H14 ABC2D9E14 -54.09 3.91 -8.44 -0.32 0
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70482 48413413 1 O2S2N3C20H23 A2B2C3D20E23 -17.12 3.17 -8.62 -0.47 0
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70483 48413414 1 O2S2N5C16H19 A2B2C5D16E19 6.1 6.64 -8.41 -0.28 0
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70484 48413415 1 FO2S2N3C19H20 AB2C2D3E19F20 -64.35 7.1 -8.46 -0.93 0
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70485 48413416 1 FO2S2N3C19H20 AB2C2D3E19F20 -68.3 6.92 -8.67 -0.95 0
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70486 48413417 1 S2O3N4C19H20 A2B3C4D19E20 -49.11 4.54 -8.51 -1.22 0
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70487 48413418 1 F2O2S2N3H17C18 A2B2C2D3E17F18 -100.14 4.84 -8.59 -1.33 0
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70488 48413421 1 S2N3O3C20H21 A2B3C3D20E21 -48.59 4.45 -8.49 -0.62 0
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70489 48413422 1 O2N3S3C17H19 A2B3C3D17E19 -15.93 6.19 -8.64 -0.95 0
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70490 48413423 1 O2S2N5C18H23 A2B2C5D18E23 -21.67 6.77 -8.64 -0.4 0
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70491 48413424 2 OSN2C8H12 ABC2D8E12 -45.43 3.92 -8.51 -0.37 0
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70492 48413427 1 S2O3N4C18H26 A2B3C4D18E26 -86.3 3.22 -8.6 -0.47 0
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70493 48413428 1 S2O3N4C16H22 A2B3C4D16E22 -74.68 4.05 -8.6 -0.43 0
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70494 48413430 1 ClO2S2N3C18H18 AB2C2D3E18F18 -15.44 2.41 -8.58 -1.03 0
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70495 48413431 2 SN2O2C9H9 AB2C2D9E9 -7.18 4.44 -8.7 -2.0 0
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70496 48413432 1 S2N3O3C19H21 A2B3C3D19E21 -49.54 4.67 -8.54 -0.58 0
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70497 48413433 2 SN2O2C9H9 AB2C2D9E9 -6.7 7.38 -8.44 -1.94 0
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70498 48413434 1 O2S2N3C19H21 A2B2C3D19E21 -17.19 4.46 -8.55 -0.6 0
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70499 48413435 1 F2O2S2N3H17C18 A2B2C2D3E17F18 -103.66 6.06 -8.44 -1.26 0
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70500 48413436 1 ClO2S2N4C17H17 AB2C2D4E17F17 -4.88 4.04 -8.53 -1.49 0
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70501 48413437 1 O2S2N4H18C19 A2B2C4D18E19 27.5 2.94 -8.68 -1.28 0