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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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269300 103616862 1 OC12H16 AB12C16 -26.34 1.2 -8.55 0.55 0
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269301 103616892 1 NO2C17H23 AB2C17D23 -72.17 6.83 -8.81 -0.44 0
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269302 103616900 1 O3N4H10C12 A3B4C10D12 -28.03 6.21 -9.16 -1.18 0
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269303 103616901 2 NOC6H6 ABC6D6 -45.09 4.01 -9.09 -1.13 0
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269304 103616909 1 N3C16H23 A3B16C23 21.75 5.72 -8.69 0.09 0
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269305 103616910 1 F2N3C15H19 A2B3C15D19 -58.77 5.93 -8.88 -0.69 0
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269306 103616934 1 SO2F3N3C8H8 AB2C3D3E8F8 -140.93 5.69 -9.58 -1.43 0
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269307 103616942 1 ClN2O2S2F3C8H8 AB2C2D2E3F8G8 -211.7 1.25 -10.0 -1.51 0
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269308 103616943 1 BrNS2F3O3C10H11 ABC2D3E3F10G11 -252.65 6.84 -9.76 -1.03 0
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269309 103616953 1 ClOSN2F3H8C9 ABCD2E3F8G9 -178.7 3.65 -10.21 -1.25 0
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269310 103616958 1 O3N5C12H17 A3B5C12D17 -92.37 7.83 -9.62 -1.09 0
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269311 103616959 1 SO2N3C10H13 AB2C3D10E13 -39.87 4.75 -8.7 -1.12 0
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269312 103616960 1 SN2O2C13H16 AB2C2D13E16 -34.16 4.34 -8.96 -0.23 0
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269313 103616961 1 FSN2C11H11 ABC2D11E11 3.14 3.87 -9.36 -0.35 0
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269314 103616964 1 SN2F3H11C12 AB2C3D11E12 -108.91 4.65 -9.43 -0.77 0
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269315 103616969 1 OSN2C12H14 ABC2D12E14 8.78 1.49 -9.06 -0.26 0
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269316 103616970 1 FSN2C11H11 ABC2D11E11 3.84 1.14 -9.46 -0.53 0
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269317 103616971 1 SN2H14C15 AB2C14D15 67.41 1.62 -9.03 -0.65 0
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269318 103616973 1 SN2C12H14 AB2C12D14 41.19 1.23 -9.19 -0.5 0
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269319 103616983 1 OSN2F3H11C12 ABC2D3E11F12 -152.26 5.16 -9.49 -0.7 0
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269320 103616984 1 SN2C12H14 AB2C12D14 45.46 1.39 -9.26 -0.3 0
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269321 103616986 1 SN2C15H20 AB2C15D20 26.75 1.64 -9.28 -0.33 0
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269322 103616987 1 SN2C13H16 AB2C13D16 32.26 1.59 -9.06 -0.48 0
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269323 103616993 1 FSN2C11H11 ABC2D11E11 2.01 2.41 -9.42 -0.4 0
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269324 103616994 1 SN2C11H20 AB2C11D20 -7.85 1.61 -9.44 -0.47 0