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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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10381 101371 1 O3C18H20 A3B18C20 -95.54 2.92 -8.95 -0.12 0
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10382 101386 1 O3H10C14 A3B10C14 -63.44 6.42 -10.25 -1.21 0
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10383 101389 1 PSN3O9H12C18 ABC3D9E12F18 -125.93 3.92 -10.73 -2.12 0
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10384 101390 2 NOC4H5 ABC4D5 -36.71 2.26 -9.3 -0.08 0
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10385 101391 1 ClO2N3C4H8 AB2C3D4E8 -48.39 2.03 -10.1 -0.7 0
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10386 101400 1 OSN4C7H8 ABC4D7E8 33.9 3.09 -9.37 -1.14 0
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10387 101405 4 OC2H2 AB2C2 -109.62 0.38 -10.05 -1.88 0
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10388 101408 1 PN2O2C5H15 AB2C2D5E15 -150.67 1.94 -9.18 1.12 0
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10389 101413 2 PSN3C6H12 ABC3D6E12 -9.94 7.1 -8.97 0.56 0
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10390 101414 1 OPN3C10H14 ABC3D10E14 -14.12 2.85 -8.66 0.38 0
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10391 101415 1 N3C12H19 A3B12C19 51.03 3.38 -8.2 0.0 0
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10392 101416 1 N3C12H19 A3B12C19 44.48 3.11 -8.31 -0.05 0
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10393 101417 1 N3C14H23 A3B14C23 37.71 3.14 -8.29 -0.02 0
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10394 101423 2 NO2H6C9 AB2C6D9 59.0 0.03 -10.03 -1.72 0
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10395 101424 2 NSeO2H4C6 ABC2D4E6 50.66 0.18 -9.11 -2.43 0
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10396 101427 2 O3N4C11H18 A3B4C11D18 -187.72 2.8 -8.16 -0.96 0
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10397 101428 2 O2N4C9H16 A2B4C9D16 -109.69 3.07 -7.87 -0.69 0
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10398 101431 1 SN2O4C9H12 AB2C4D9E12 -147.58 5.68 -9.57 -0.97 0
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10399 101432 1 NO5H13C15 AB5C13D15 -59.09 5.18 -9.12 -1.52 0
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10400 101434 1 O2N5C7H9 A2B5C7D9 -8.54 3.18 -10.07 -1.4 0
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10401 101437 1 NO4C10H11 AB4C10D11 -147.78 7.31 -8.86 -0.41 0
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10402 101438 1 ON2H6C7 AB2C6D7 16.1 1.05 -8.74 -0.54 0
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10403 101442 1 SO3N7C10H11 AB3C7D10E11 -26.9 7.12 -9.08 -1.44 0
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10404 101446 2 ON2C5H6 AB2C5D6 -31.9 3.83 -9.14 -0.58 0
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10405 101455 1 NO3C7H9 AB3C7D9 -86.3 5.3 -10.2 -0.83 0
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10406 101459 1 S2N3C4H7 A2B3C4D7 49.83 2.35 -8.64 -0.9 0
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10407 101460 1 BrON2C7H7 ABC2D7E7 0.5 3.3 -9.63 -0.86 0
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10408 101461 1 BrNO4C12H16 ABC4D12E16 -134.99 4.36 -8.97 -0.5 0
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10409 101463 2 N2C3H3 A2B3C3 64.91 0.01 -8.96 -0.24 0
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10410 101464 1 OSN2H10C13 ABC2D10E13 14.09 2.9 -8.29 -0.46 0
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10411 101466 1 ON2C9H10 AB2C9D10 10.6 3.52 -9.89 -0.7 0
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10412 101469 1 NBr2H3O3C6 AB2C3D3E6 -13.35 4.58 -10.0 -1.54 0
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10413 101470 1 ClNBr2O2H6C10 ABC2D2E6F10 -51.51 2.88 -9.37 -1.76 0
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10414 101478 1 NSC8H9 ABC8D9 38.11 2.41 -9.07 -0.25 0
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10415 101480 1 SN2O2C11H18 AB2C2D11E18 -63.32 6.7 -8.91 -0.33 0
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10416 101483 2 NOC4H5 ABC4D5 -63.68 3.05 -8.79 0.1 0
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10417 101524 1 Cl2N4O7C33H34 A2B4C7D33E34 -233.2 7.04 -8.39 -1.49 0
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10418 101550 1 OC8H12 AB8C12 -35.84 3.24 -9.72 0.46 0
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10419 101570 1 NC16H20 AB16C20 68.57 3.75 0.0 0.0 1
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10420 101581 1 OC40H58 AB40C58 -2.87 2.62 -8.1 0.04 0
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10421 101582 1 NO3C20H39 AB3C20D39 -196.85 3.74 -9.68 1.04 0
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10422 101584 1 ClN2O5C22H33 AB2C5D22E33 -251.26 4.64 -8.36 0.06 0
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10423 101605 1 N2Cl3C18H23 A2B3C18D23 -31.55 2.93 -8.94 -0.55 0
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10424 101609 1 PN2C9O9H13 AB2C9D9E13 -443.58 5.08 -10.55 -1.15 0
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10426 101636 1 N2H12C19 A2B12C19 104.51 3.61 -8.29 -1.06 0
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10428 101672 1 ClF2C3H5 AB2C3D5 -129.59 2.45 -11.07 0.22 0
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10429 101682 1 N2O3C21H22 A2B3C21D22 68.47 5.72 -8.8 -0.03 0
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10430 101809 1 NO3C24H25 AB3C24D25 -46.56 3.12 -8.49 0.0 0
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10431 101813 1 ClNO2C15H20 ABC2D15E20 -102.87 2.5 -9.0 -0.62 0
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10432 101839 2 OC10H19 AB10C19 -160.51 1.62 -9.57 0.83 0