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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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181591 76764250 1 FO4H11C12 AB4C11D12 -167.75 0.95 -9.11 -0.44 0
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181592 76764251 1 ON2C10H12 AB2C10D12 39.72 2.26 -10.18 -1.05 0
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181593 76764252 2 NOC5H6 ABC5D6 -54.31 3.55 -10.75 -0.34 0
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181594 76764253 1 ClNO2C10H12 ABC2D10E12 -48.0 5.4 -8.64 -1.1 0
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181595 76764254 1 O2C11H14 A2B11C14 -84.32 1.53 -9.02 0.14 0
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181596 76764255 1 NO3C20H29 AB3C20D29 -162.89 1.22 -9.29 0.32 0
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181597 76764764 1 FCl2O3H11C15 AB2C3D11E15 -145.84 3.98 -9.51 -1.14 0
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181598 76764765 1 NO6C18H25 AB6C18D25 -229.37 4.79 -9.5 -0.71 0
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181599 76765182 1 F2O3N4C26H36 A2B3C4D26E36 -179.68 3.02 -8.83 -0.69 0
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181600 76765458 1 NO4C34H57 AB4C34D57 -229.16 4.56 -8.55 0.17 0
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181601 76765623 1 SO3N5H23C24 AB3C5D23E24 12.82 4.4 -8.64 -0.86 0
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181602 76765624 1 ON3C7H9 AB3C7D9 0.09 3.94 -8.09 0.24 0
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181603 76765671 1 N2O6C21H24 A2B6C21D24 -174.61 6.17 -8.73 -0.76 0
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181604 76765867 1 O3C33H46 A3B33C46 -140.35 7.51 -8.48 -1.1 0
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181605 76765868 1 O3C30H40 A3B30C40 -125.42 4.06 -8.54 -1.19 0
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181606 76765869 1 NO3C36H45 AB3C36D45 -92.13 7.19 -8.57 -1.21 0
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181607 76765870 1 O3C31H42 A3B31C42 -132.62 6.88 -8.49 -1.11 0
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181608 76765871 1 S3N6Na7O14H27C42 A3B6C7D14E27F42 -526.41 18.47 -5.0 -0.55 0
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181609 76765872 1 S4N6Na8O17H24C41 A4B6C8D17E24F41 -424.75 100.07 -5.28 -3.39 0
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181610 76766079 1 ClN2O7C25H27 AB2C7D25E27 -270.84 9.1 -9.15 -0.88 0
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181611 76766080 1 NSCl2O7C24H25 ABC2D7E24F25 -264.32 2.4 -8.73 -1.12 0
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181612 76766081 1 NSCl2O5C21H21 ABC2D5E21F21 -180.64 7.5 -9.08 -0.94 0
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181613 76766108 1 ClN3O5C25H28 AB3C5D25E28 -170.01 7.4 -8.98 -0.56 -2
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181614 76766441 1 YC17H36 AB17C36 69.24 0.27 0.0 0.0 0
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181615 76766909 1 OSF3N3H14C21 ABC3D3E14F21 -64.87 4.23 -8.93 -1.96 0