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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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83502 49857667 1 ON2H10C16 AB2C10D16 88.85 3.08 -9.39 -0.98 0
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83503 49857668 1 F2N2O3C9H16 A2B2C3D9E16 -254.96 6.12 -10.18 0.33 0
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83504 49857670 1 F2N3O3C12H15 A2B3C3D12E15 -203.78 2.19 -10.29 -0.9 0
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83505 49857673 1 SO3N6C32H34 AB3C6D32E34 -29.92 7.06 -8.39 -0.88 0
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83506 49857675 1 BrO3C22H31 AB3C22D31 -134.58 4.41 -8.5 -0.29 0
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83507 49857676 1 O3C22H32 A3B22C32 -140.64 2.28 -8.46 -0.12 0
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83508 49857677 1 O3C22H32 A3B22C32 -141.98 2.89 -8.34 0.03 0
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83509 49857678 1 BrO2C22H29 AB2C22D29 -75.31 3.65 -8.62 -0.4 0
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83510 49857679 2 OC11H15 AB11C15 -81.52 0.57 -8.4 -0.08 0
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83511 49857681 2 FN3H7C8 AB3C7D8 17.14 1.34 -9.57 -0.63 0
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83512 49857682 2 F2N3H6C8 A2B3C6D8 -59.75 3.86 -9.62 -1.06 0
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83513 49857683 2 ON3C9H10 AB3C9D10 23.01 3.09 -9.2 -0.51 0
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83514 49857684 2 FON3C9H9 ABC3D9E9 -56.53 2.07 -9.18 -0.86 0
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83515 49857686 1 FSN6C17H17 ABC6D17E17 64.01 2.99 -8.8 -0.6 0
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83516 49857687 1 NO5C25H25 AB5C25D25 -106.78 1.87 -8.68 -0.23 0
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83518 49857690 1 BFN2O4C25H26 ABC2D4E25F26 -240.28 1.11 -9.27 -0.41 0
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83520 49857694 1 NO3C17H17 AB3C17D17 -94.61 6.68 -9.68 -0.58 0
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83521 49857695 1 NO3C17H17 AB3C17D17 -100.1 2.11 -9.42 -0.28 0
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83522 49857696 1 FN2O3H13C15 AB2C3D13E15 -121.84 4.31 -10.19 -1.09 0
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83523 49857697 1 FN2O3H13C15 AB2C3D13E15 -122.3 6.69 -10.21 -1.15 0
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83524 49857698 1 FN2O3H13C15 AB2C3D13E15 -122.27 6.09 -10.13 -1.15 0
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83525 49857702 1 BFN3O5C34H39 ABC3D5E34F39 -261.23 6.69 -9.18 -0.44 0
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83526 49857703 1 BN3O5C35H42 AB3C5D35E42 -222.16 7.6 -9.08 -0.37 0
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83527 49857705 1 N3O5C15H23 A3B5C15D23 -165.09 8.81 -8.0 -0.15 0
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83528 49857706 1 N3O5C10H15 A3B5C10D15 -128.35 3.17 -8.94 -1.34 0
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83529 49857707 1 N3O5C11H15 A3B5C11D15 -112.91 5.4 -8.7 -1.4 0
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83530 49857709 1 N3O5C13H17 A3B5C13D17 -96.45 10.42 -9.04 -1.9 0
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83531 49857710 1 N3O5C13H19 A3B5C13D19 -127.11 8.87 -9.01 -1.8 0
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83532 49857711 1 N3O5C16H17 A3B5C16D17 -81.59 6.82 -8.73 -1.78 0
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83533 49857712 1 O3N5C28H35 A3B5C28D35 -5.14 8.61 -9.05 -0.7 0
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83534 49857713 2 ClNC6H8 ABC6D8 -1.0 4.21 -9.52 -0.5 0
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83535 49857714 1 ClN5F6O6H20C21 AB5C6D6E20F21 -465.09 5.38 -9.92 -1.55 0
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83536 49857715 1 ClFN3C15H17 ABC3D15E17 -10.32 3.22 -9.31 -1.36 0
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83537 49857716 1 O3C16H18 A3B16C18 -90.28 3.71 -9.15 -0.03 0
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83538 49857719 2 NOC9H9 ABC9D9 -6.85 6.28 -8.78 -0.81 0
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83539 49857720 1 N2O3H12C15 A2B3C12D15 -49.35 4.46 -9.09 -1.32 0
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83540 49857721 2 NO2C9H9 AB2C9D9 -112.09 4.72 -9.04 -1.26 0
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83541 49857722 1 N2O2H10C13 A2B2C10D13 0.78 4.79 -8.66 -1.27 0
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83542 49857723 1 N2O3H12C15 A2B3C12D15 -45.21 6.3 -9.12 -1.24 0
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83543 49857727 1 ClON3C23H24 ABC3D23E24 18.79 6.84 -8.48 -0.24 0
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83544 49857728 1 ClON3C24H26 ABC3D24E26 12.9 5.89 -8.35 -0.44 0
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83545 49857729 1 ClON3C24H26 ABC3D24E26 15.14 6.65 -8.46 -0.47 0
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83546 49857756 1 O7N9C35H41 A7B9C35D41 -208.76 6.54 -8.52 -0.53 0
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83547 49857808 1 N2O3C22H34 A2B3C22D34 -125.56 5.4 -8.74 -0.22 0
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83548 49857809 1 N2O3C26H34 A2B3C26D34 -82.3 5.14 -8.74 -0.23 0
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83549 49857821 1 N3O4C27H27 A3B4C27D27 -64.42 5.94 -9.15 -1.2 0
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83550 49857829 1 OF4N5H21C22 AB4C5D21E22 -151.73 2.37 -8.94 -0.41 0
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83551 49857847 1 SiO4C23H44 AB4C23D44 -283.83 1.98 -8.76 1.26 0
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83552 49857855 1 NSO8C39H63 ABC8D39E63 -400.16 12.48 -9.68 -1.61 0
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83553 49857863 1 BrO3C21H27 AB3C21D27 -124.28 2.19 -8.54 -0.58 0