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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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305055 124766473 1 ClSN3O6C22H22 ABC3D6E22F22 -66.62 9.47 -9.28 -1.6 0
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305056 124766474 1 ClSN3O6C22H22 ABC3D6E22F22 -82.54 3.41 -9.15 -1.64 0
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305057 124766475 1 ClSN3O6C22H22 ABC3D6E22F22 -81.2 3.89 -9.26 -1.98 0
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305058 124766477 1 ClO3N5C16H20 AB3C5D16E20 58.76 3.62 -9.46 -1.85 0
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305064 124766484 1 FNO6C18H22 ABC6D18E22 -281.95 4.9 -8.95 -0.26 0
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305065 124766485 1 FNO6C18H22 ABC6D18E22 -258.53 4.88 -9.07 -0.34 1
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305067 124766487 1 NO4C19H26 AB4C19D26 -116.94 2.16 0.0 0.0 1
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305068 124766488 1 NO4C19H26 AB4C19D26 -115.02 2.38 0.0 0.0 0
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305073 124766493 1 SN3O4C23H27 AB3C4D23E27 -52.28 2.06 -8.8 -0.78 0
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305078 124766498 1 N2O6C7H14 A2B6C7D14 -273.21 5.32 -10.14 0.53 0
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305079 124766499 1 N2O6C7H14 A2B6C7D14 -273.76 3.21 -10.05 0.52 1
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305081 124766502 1 NC14H24 AB14C24 17.65 0.2 0.0 0.0 1
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305087 124766508 1 NO3H13C18 AB3C13D18 -1.45 2.17 -8.88 -0.64 0
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305088 124766509 1 SN3O3C15H23 AB3C3D15E23 -118.56 8.78 -9.79 -0.88 0
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305092 124766514 1 BrN2O4H33C36 AB2C4D33E36 -68.37 2.06 -9.13 -0.84 0
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305093 124766515 1 ClS2N4O6H21C24 AB2C4D6E21F24 -22.29 11.36 -9.22 -1.78 0
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305094 124766517 1 ClSN4O8H19C25 ABC4D8E19F25 -38.28 7.05 -9.76 -2.05 0
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305095 124766518 1 ClSN4O8H19C25 ABC4D8E19F25 -33.54 6.38 -9.45 -1.73 0
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305096 124766519 1 ClSN4O8H19C25 ABC4D8E19F25 -32.38 6.84 -9.13 -1.7 0
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305097 124766520 1 ClSN4O8H19C25 ABC4D8E19F25 -30.0 8.17 -9.7 -2.02 0
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305098 124766521 1 ClSN3O6H16C19 ABC3D6E16F19 -56.21 3.31 -9.05 -1.54 0
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305099 124766522 1 ClSN3O6H16C19 ABC3D6E16F19 -60.92 6.79 -9.57 -1.86 0
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305101 124766525 1 NF3O3H14C16 AB3C3D14E16 -236.9 6.87 -9.75 -0.94 0
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305102 124766526 1 BrN2O3H13C16 AB2C3D13E16 -4.09 2.61 -9.97 -0.78 0
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305103 124766527 1 N3O9C23H31 A3B9C23D31 -374.77 2.99 -8.49 -0.17 0