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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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36400 8005637 1 ClNO2H14C18 ABC2D14E18 -6.52 2.03 -8.87 -0.59 0
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36401 8005643 1 SN3O5C19H21 AB3C5D19E21 -126.73 7.88 -9.15 -0.68 -1
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36402 8005740 1 OSN2H11C15 ABC2D11E15 64.48 10.22 0.0 0.0 0
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36403 8005746 1 S2N3O3H17C19 A2B3C3D17E19 -9.21 3.78 -9.23 -0.82 0
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36404 8005790 1 SO2N3C21H25 AB2C3D21E25 -33.87 4.66 -8.43 -0.32 0
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36405 8005843 1 ON2C21H26 AB2C21D26 -15.03 3.35 -9.47 0.02 -1
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36406 8005855 1 N2O3C14H21 A2B3C14D21 -129.83 2.91 0.0 0.0 0
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36407 8005934 1 N3O5C19H19 A3B5C19D19 -142.47 3.86 -8.89 -0.4 0
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36408 8006048 2 OSN2H9C10 ABC2D9E10 77.68 5.09 -9.02 -1.16 0
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36409 8006075 1 BrOSN4H15C17 ABCD4E15F17 66.07 5.52 -8.94 -1.0 0
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36410 8006083 1 SO3N5C18H19 AB3C5D18E19 -70.22 1.45 -8.57 -0.87 0
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36411 8006094 1 O4N5H19C22 A4B5C19D22 -28.97 3.6 -8.54 -1.17 0
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36412 8006164 1 ClFSN3O3H11C17 ABCD3E3F11G17 -10.82 4.62 -9.45 -2.18 0
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36413 8006206 1 ClSN3O4H16C17 ABC3D4E16F17 -62.02 7.3 -9.52 -1.13 0
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36414 8006208 1 ClOS2N4C17H19 ABC2D4E17F19 28.72 2.08 -8.92 -1.02 0
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36415 8006213 1 N2S2O5C18H22 A2B2C5D18E22 -163.18 3.42 -8.93 -0.66 0
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36416 8006237 1 N3O4H21C22 A3B4C21D22 -107.82 2.32 -8.56 -1.38 0
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36417 8006240 1 BrN2O4C16H17 AB2C4D16E17 -119.42 4.57 -9.66 -1.1 0
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36418 8006293 1 O2N3C20H21 A2B3C20D21 31.21 4.88 -8.75 -0.37 0
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36419 8006303 1 OSF3N5H12C17 ABC3D5E12F17 -40.35 5.71 -9.7 -1.44 0
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36420 8006309 1 FSO2N3H20C21 ABC2D3E20F21 -52.83 4.0 -9.02 -0.98 0
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36421 8006319 1 N2O3H18C19 A2B3C18D19 -66.95 2.29 -9.46 -1.32 0
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36422 8006327 1 SO2N3C13H15 AB2C3D13E15 -35.55 9.88 -9.43 -0.9 0
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36423 8006343 2 ON2C10H13 AB2C10D13 -65.21 4.67 -8.83 -0.13 0
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36424 8006366 1 ClSO2N3H16C19 ABC2D3E16F19 14.49 7.12 -8.91 -1.22 0