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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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296700 117589095 1 O3N4C15H18 A3B4C15D18 -41.13 6.72 -8.99 -0.92 0
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296701 117589101 1 O2N5C20H21 A2B5C20D21 34.17 6.85 -8.35 -1.2 0
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296702 117589112 1 BrO2N5H18C19 AB2C5D18E19 47.5 4.48 -8.37 -1.54 0
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296703 117589167 2 O2N3C10H10 A2B3C10D10 44.03 8.13 -8.91 -1.8 0
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296704 117589260 1 O2F3N4C15H15 A2B3C4D15E15 -163.71 3.38 -9.04 -1.57 0
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296705 117589275 1 O4N5C15H17 A4B5C15D17 -1.45 8.7 -8.95 -1.74 0
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296706 117589324 2 N2O2C9H12 A2B2C9D12 -102.61 9.29 -8.73 -1.05 0
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296707 117589329 1 N5O5C16H19 A5B5C16D19 -49.57 9.55 -9.26 -1.79 0
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296708 117589347 1 O3N4H18C19 A3B4C18D19 -4.8 7.39 -8.74 -1.06 0
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296709 117589398 1 O2N5C15H19 A2B5C15D19 -0.06 6.45 -8.56 -1.13 0
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296710 117589531 1 O3N4C13H16 A3B4C13D16 -42.87 6.18 -8.92 -1.29 0
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296711 117589535 1 O3N4C15H20 A3B4C15D20 -61.8 6.42 -8.62 -1.04 0
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296712 117589547 1 N5O5C13H15 A5B5C13D15 -47.05 2.78 -9.27 -2.26 0
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296713 117589728 1 O3N4C13H14 A3B4C13D14 -17.18 6.6 -8.72 -1.05 0
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296714 117589740 2 ON2C7H8 AB2C7D8 5.99 6.31 -9.3 -1.0 0
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296715 117589833 1 O2N5C14H15 A2B5C14D15 46.46 3.45 -9.0 -1.18 0
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296716 117589900 1 FN6C21H21 AB6C21D21 101.15 6.18 -8.78 -0.92 0
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296717 117589930 1 N5C14H15 A5B14C15 115.48 4.7 -8.63 -0.89 0
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296718 117589948 1 N5C15H17 A5B15C17 102.6 5.53 -8.64 -0.84 0
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296719 117590072 1 BrON5C16H18 ABC5D16E18 68.07 6.02 -9.1 -1.32 0
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296720 117590083 1 ON5C18H23 AB5C18D23 50.86 5.09 -8.72 -0.95 0
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296721 117590151 1 ClN6C14H15 AB6C14D15 122.98 6.07 -8.93 -1.31 0
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296722 117590192 1 F3N6C16H17 A3B6C16D17 -29.84 4.84 -8.86 -1.37 0
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296723 117590394 1 O2N6H14C17 A2B6C14D17 153.23 8.27 -9.07 -1.79 0
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296724 117590399 1 N5C19H19 A5B19C19 132.17 5.3 -8.72 -0.88 0
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296725 117590418 1 ClN5H16C18 AB5C16D18 139.19 4.32 -8.78 -1.21 0
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296726 117590466 1 ON5C14H15 AB5C14D15 102.67 4.64 -8.98 -0.84 0
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296727 117590496 1 ON5C14H17 AB5C14D17 68.69 5.7 -8.58 -0.81 -3
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296728 117590592 1 IrO6C15H21 AB6C15D21 -158.13 10.98 -9.91 -3.75 0
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296729 117590614 1 N2O3C30H42 A2B3C30D42 -103.24 4.27 -8.42 -0.43 0
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296730 117590684 1 O17C69H100 A17B69C100 -768.19 8.58 -8.9 0.12 0
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296731 117590751 1 NO8C42H45 AB8C42D45 -165.16 4.72 -8.73 -0.53 0
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296733 117590886 1 Cl2N3O6C42H49 A2B3C6D42E49 -151.68 4.42 -8.59 -0.42 0
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296734 117590905 1 N10O19C80H102 A10B19C80D102 -691.15 6.83 -8.74 -1.89 0
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296736 117591015 1 ClFNO5C43H55 ABCD5E43F55 -285.94 4.63 -9.11 -0.62 0
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296737 117591067 1 ClN4O4C32H45 AB4C4D32E45 -74.92 8.8 -9.19 -0.53 0
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296738 117591109 1 N10O22C89H116 A10B22C89D116 -839.9 5.88 -8.63 -1.83 0
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296739 117591138 1 N10O20C81H104 A10B20C81D104 -779.9 14.38 -8.08 -2.33 0
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296740 117591233 1 ClN3O6C25H32 AB3C6D25E32 -207.3 5.53 -9.18 -0.31 0
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296741 117591253 1 NO6C37H41 AB6C37D41 -75.16 13.89 -7.87 -2.7 0
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296742 117591257 1 NO9H35C36 AB9C35D36 -283.37 4.3 -8.14 -0.69 0
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296743 117591281 1 NO5C35H43 AB5C35D43 -204.97 2.59 -8.82 -0.7 0
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296744 117591287 1 NNaCl2O5C36H42 ABC2D5E36F42 -319.41 9.81 -7.47 -0.07 0
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296745 117591300 1 O9C45H56 A9B45C56 -374.18 4.72 -8.41 -0.59 0
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296746 117591301 1 ClN5O11C37H56 AB5C11D37E56 -483.26 12.12 -8.82 -1.08 0
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296747 117591313 1 O14H36C39 A14B36C39 -469.35 8.39 -8.86 -1.01 0
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296748 117591349 1 NO6C41H57 AB6C41D57 -237.46 12.52 -8.12 -0.52 0
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296749 117591361 1 ClN3O27C68H112 AB3C27D68E112 -1205.91 3.78 -8.09 -0.54 0
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296750 117591377 1 O8C45H62 A8B45C62 -372.31 6.38 -9.05 -1.38 0
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296751 117591391 1 Cl3N5O6C30H40 A3B5C6D30E40 -216.32 6.57 -9.01 -0.76 0