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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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214270 84974850 1 O2N3C22H29 A2B3C22D29 -63.59 5.65 -8.21 -0.21 1
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214271 84974856 1 BrSO2N3C14H19 ABC2D3E14F19 -20.89 8.35 0.0 0.0 0
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214272 84974861 1 ClN2S2O3C14H21 AB2C2D3E14F21 -102.27 3.25 -8.71 -1.22 0
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214273 84974865 1 ClS2N3O3C11H16 AB2C3D3E11F16 -95.96 2.1 -9.02 -1.32 1
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214274 84974866 1 ClO2S2N3C11H15 AB2C2D3E11F15 -1.42 7.83 0.0 0.0 1
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214275 84974874 1 ClS2N3O3C17H27 AB2C3D3E17F27 -96.91 4.54 0.0 0.0 0
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214276 84974887 1 SO3N4C19H22 AB3C4D19E22 -45.76 9.08 -7.86 -1.35 0
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214277 84974889 1 BrO2N4C15H17 AB2C4D15E17 -39.22 1.09 -9.18 -1.18 0
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214278 84974890 1 FON2C18H19 ABC2D18E19 -28.58 4.57 -8.15 -0.58 1
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214279 84974891 1 O2N3C21H26 A2B3C21D26 -41.55 4.07 0.0 0.0 1
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214280 84974894 1 O3N4C18H27 A3B4C18D27 -103.84 3.36 0.0 0.0 1
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214281 84974899 1 O2N3C17H24 A2B3C17D24 -66.81 1.03 0.0 0.0 1
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214282 84974902 1 ClO2N3C16H23 AB2C3D16E23 -78.75 1.42 0.0 0.0 0
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214283 84974903 1 ClO2N3C16H22 AB2C3D16E22 -99.84 1.06 -8.94 0.03 0
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214284 84974905 1 SN3O4C18H25 AB3C4D18E25 -157.08 6.94 -8.65 -0.64 1
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214285 84974913 1 N2O4C18H23 A2B4C18D23 -129.52 8.22 0.0 0.0 0
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214286 84974914 2 NO2C9H11 AB2C9D11 -135.79 3.58 -9.04 -0.87 0
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214287 84974919 1 O2N3C19H31 A2B3C19D31 -128.96 4.67 -9.4 0.95 0
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214288 84974927 1 BrO2N3C15H20 AB2C3D15E20 -78.67 4.11 -9.05 -0.43 0
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214289 84974932 2 NOC10H12 ABC10D12 -30.19 3.24 -8.15 -0.4 1
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214290 84974934 1 N3O4C17H24 A3B4C17D24 -133.08 1.41 0.0 0.0 0
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214291 84974935 1 N3O4C17H23 A3B4C17D23 -153.85 4.93 -8.48 -0.21 0
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214292 84974939 1 O2N3C21H25 A2B3C21D25 -56.98 4.15 -8.93 -0.15 1
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214293 84974948 1 O3N4C21H25 A3B4C21D25 -74.08 4.74 0.0 0.0 1
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214294 84974966 1 N3O3C22H28 A3B3C22D28 -71.75 2.44 0.0 0.0 1