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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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159618 57288541 1 SO8C22H30 AB8C22D30 -342.95 7.05 -9.29 -1.56 0
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159619 57288542 1 O2N3C15H21 A2B3C15D21 -48.88 2.16 -9.2 -0.02 0
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159620 57288543 1 NS2O4C21H25 AB2C4D21E25 -130.96 6.61 -8.91 -1.6 0
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159621 57288544 1 ClSO2N3H18C22 ABC2D3E18F22 23.99 5.91 -8.57 -1.47 0
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159622 57288546 1 Cl2O2N3H31C33 A2B2C3D31E33 29.41 6.57 -8.94 -0.76 0
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159623 57288547 1 ON8H20C22 AB8C20D22 162.97 3.83 -8.61 -0.85 0
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159624 57288548 2 OC10H12 AB10C12 -75.51 1.04 -8.57 0.24 0
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159625 57288549 1 N2O3H6C13 A2B3C6D13 -22.34 2.17 -9.21 -1.57 0
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159626 57288551 1 SN3O6C29H41 AB3C6D29E41 -265.87 3.54 -9.02 -0.06 0
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159627 57288552 1 SN4O4C19H22 AB4C4D19E22 -65.08 5.68 -8.9 -0.5 0
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159628 57288553 1 SN3O6C25H29 AB3C6D25E29 -145.35 9.06 -9.25 -1.45 0
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159629 57288557 1 N2S2O4C25H34 A2B2C4D25E34 -161.43 4.18 -8.94 -0.8 0
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159630 57288558 1 P2Cl4O7C10H20 A2B4C7D10E20 -507.4 3.16 -10.9 -0.54 0
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159631 57288559 2 NO2H10C12 AB2C10D12 -23.28 5.83 -7.47 -1.74 -1
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159632 57288560 1 SC2H2O2Br3 AB2C2D2E3 -38.67 1.65 0.0 0.0 0
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159633 57288561 1 SC2O2Br3H3 AB2C2D3E3 -58.66 2.21 -9.47 -1.73 0
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159634 57288562 1 NSF3O4C12H14 ABC3D4E12F14 -313.26 4.87 -10.15 -1.2 0
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159636 57288564 1 SN2O5C8H10 AB2C5D8E10 -185.68 8.8 -9.17 -1.13 0
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159637 57288565 1 Cl2O2H8C11 A2B2C8D11 -60.81 4.18 -9.78 -0.48 0
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159638 57288566 1 N3O4C14H19 A3B4C14D19 -166.48 3.11 -9.83 -0.06 0
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159639 57288567 1 N2O11C50H76 A2B11C50D76 -492.14 3.66 -8.49 -0.93 0
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159640 57288568 1 PN2O4C5H9 AB2C4D5E9 -162.92 1.4 -9.43 -0.98 1
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159641 57288569 1 PN2O4C5H10 AB2C4D5E10 -164.41 6.99 0.0 0.0 0
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159642 57288570 1 N4O4C23H26 A4B4C23D26 -125.87 4.67 -8.94 -0.41 0
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159643 57288572 2 N3O3C10H15 A3B3C10D15 -201.13 5.33 -9.6 -0.29 0