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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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81878 49855290 1 ClSO4N5H20C24 ABC4D5E20F24 -33.91 6.96 -8.63 -1.02 0
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81879 49855295 1 NO3C22H23 AB3C22D23 -76.84 3.84 -8.77 -0.7 0
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81880 49855296 1 FNO3H20C21 ABC3D20E21 -114.28 6.5 -8.97 -0.82 0
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81881 49855297 1 ClOSN4C20H27 ABCD4E20F27 -12.07 8.62 -8.42 -0.56 0
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81882 49855298 1 NO4C15H19 AB4C15D19 -145.04 5.43 -9.04 -0.37 0
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81883 49855301 1 SO3C12H14 AB3C12D14 -75.52 1.44 -9.14 -0.35 0
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81884 49855302 2 OC10H19 AB10C19 -151.77 5.32 -10.67 0.74 0
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81885 49855303 1 NF3O5C24H28 AB3C5D24E28 -264.65 1.33 -8.84 -0.09 0
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81886 49855304 1 NO4C28H29 AB4C28D29 -87.06 6.11 -8.62 -0.89 0
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81887 49855305 1 NO4H25C26 AB4C25D26 -73.32 5.83 -8.67 -0.86 0
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81888 49855306 1 NO5H27C28 AB5C27D28 -114.89 6.52 -8.52 -0.94 0
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81889 49855308 1 SCl2F2N2O12C58H68 AB2C2D2E12F58G68 -574.27 7.81 -8.89 -1.11 0
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81890 49855309 1 NO4H27C28 AB4C27D28 -78.21 7.24 -8.49 -0.92 0
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81891 49855310 1 N2O4C25H34 A2B4C25D34 -120.02 2.74 -8.2 0.19 0
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81892 49855311 18 CH AB 119.9 0.63 -8.68 -0.52 0
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81893 49855312 1 ClNO4C24H28 ABC4D24E28 -141.58 6.17 -8.98 -0.7 1
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81894 49855316 1 N2C23H33 A2B23C33 55.5 2.2 0.0 0.0 1
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81895 49855318 1 N2C21H29 A2B21C29 65.64 1.29 0.0 0.0 0
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81896 49855320 1 FN6O8C23H29 AB6C8D23E29 -299.43 17.11 -9.17 -1.01 0
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81897 49855324 1 ClSN2O3H19C25 ABC2D3E19F25 -23.03 4.25 -8.98 -1.28 0
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81898 49855325 1 N2O2C11H14 A2B2C11D14 -37.07 3.22 -8.98 -0.03 0
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81899 49855327 1 SN2F3O5C15H15 AB2C3D5E15F15 -297.41 13.47 -9.68 -1.28 0
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81900 49855328 1 N2O2F3H13C15 A2B2C3D13E15 -166.13 1.61 -9.21 -1.27 0
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81901 49855329 1 SF3O6C18H19 AB3C6D18E19 -374.88 5.84 -10.28 -1.54 0
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81903 49855331 1 SN5O8C37H55 AB5C8D37E55 -347.56 3.94 -8.98 -1.06 0