List Systems

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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
413438 135086387 1 BrNO2H12C16 ABC2D12E16 -14.92 5.84 -8.5 -0.88 0
413439 135086388 1 NO5C14H15 AB5C14D15 -174.51 3.59 -9.31 -0.48 0
413440 135086389 1 ClNO5C14H14 ABC5D14E14 -184.18 5.45 -9.42 -0.56 0
413441 135086390 1 NO5C15H17 AB5C15D17 -184.79 6.4 -9.33 -0.44 0
413442 135086391 1 O3C8H12 A3B8C12 -106.01 1.78 -10.51 -0.01 0
413443 135086392 1 NO3C18H23 AB3C18D23 -130.06 3.21 -9.34 -0.18 0
413444 135086393 1 NF3O3C18H20 AB3C3D18E20 -283.27 2.0 -10.33 -0.77 0
413445 135086394 1 PO2H19C21 AB2C19D21 -20.34 5.04 -8.82 -0.08 0
413446 135086395 1 PO3C18H19 AB3C18D19 -104.27 4.01 -9.9 -0.2 0
413447 135086396 1 ClNO2C12H14 ABC2D12E14 -30.97 2.06 -9.23 -0.38 0
413448 135086397 1 BO2C21H31 AB2C21D31 -170.74 2.8 -8.67 0.77 1
413449 135086398 1 NOH16C18 ABC16D18 37.78 1.71 0.0 0.0 0
413450 135086399 1 O4H16C17 A4B16C17 -95.75 6.16 -9.1 -0.76 0
413451 135086400 1 F3O3H13C17 A3B3C13D17 -220.17 3.72 -10.05 -0.94 0
413452 135086401 1 BrOSiN3C10H16 ABCD3E10F16 -8.21 4.11 -9.81 -0.67 1
413453 135086402 1 PH2O2F4C6 AB2C2D4E6 -199.63 4.87 0.0 0.0 0
413454 135086403 1 NPO6C13H18 ABC6D13E18 -283.84 5.0 -9.34 -0.65 0
413455 135086404 1 NO3C14H19 AB3C14D19 -89.47 2.54 -9.3 -0.28 0
413456 135086405 1 NOC20H25 ABC20D25 -16.92 2.89 -9.17 -0.86 0
413457 135086406 1 ClO3H13C14 AB3C13D14 -83.07 2.44 -9.2 -1.27 1
413458 135086407 1 NC9H12 AB9C12 15.78 1.73 0.0 0.0 1
413459 135086408 1 NC9H12 AB9C12 22.66 1.89 0.0 0.0 0
413460 135086409 1 SO4C16H16 AB4C16D16 -108.98 5.01 -8.85 -0.38 0
413461 135086410 1 SO3H16C19 AB3C16D19 -49.93 4.73 -8.84 -0.55 0
413462 135086411 1 ClOS2C11H11 ABC2D11E11 3.64 3.52 -8.9 -0.84 0