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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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149981 53789664 1 N17O45C212H411 A17B45C212D411 -2706.75 12.87 -8.22 -0.46 0
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149982 53789665 1 NOC9H15 ABC9D15 -42.36 2.19 -8.15 0.42 0
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149983 53789666 1 NO2C8H17 AB2C8D17 -117.43 3.55 -9.22 1.94 0
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149984 53789667 1 NOC9H19 ABC9D19 -76.74 2.6 -8.9 2.42 0
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149985 53789668 1 FN2O7C37H43 AB2C7D37E43 -277.44 8.56 -8.74 -0.42 1
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149986 53789669 1 N3O8C37H44 A3B8C37D44 -277.84 8.36 0.0 0.0 0
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149987 53789670 1 SN2O5C30H56 AB2C5D30E56 -259.53 6.05 -8.85 -0.54 0
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149988 53789671 1 SN2O4C11H16 AB2C4D11E16 -143.4 5.84 -9.76 -0.67 0
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149989 53789672 1 SN2O4C11H16 AB2C4D11E16 -144.33 6.63 -9.78 -0.63 0
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149990 53789673 1 S2N8O12H28C29 A2B8C12D28E29 -317.19 7.46 -9.01 -1.8 0
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149991 53789674 1 N2F4O5C39H50 A2B4C5D39E50 -394.27 8.81 -9.42 -1.44 0
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149992 53789675 1 NSO7C15H27 ABC7D15E27 -240.43 5.39 -9.15 -0.83 0
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149993 53789676 1 SO2N5C10H13 AB2C5D10E13 -0.25 4.37 -8.81 -0.22 0
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149994 53789677 1 O3C12H20 A3B12C20 -140.64 4.21 -9.7 0.43 0
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149995 53789678 1 NO3C18H21 AB3C18D21 -72.49 5.49 -8.2 0.28 0
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149996 53789679 1 OC12H18 AB12C18 -56.86 2.48 -9.13 0.55 0
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149997 53789680 1 NO6C22H43 AB6C22D43 -371.37 1.49 -10.07 0.04 0
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149998 53789681 1 ClN2C8H11 AB2C8D11 41.81 1.03 -8.53 0.47 0
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149999 53789682 1 NO4C24H31 AB4C24D31 -81.74 4.33 -9.08 -0.9 0
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150000 53789683 1 O2N3C15H19 A2B3C15D19 -70.87 2.61 -9.11 -0.82 0
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150001 53789684 1 N3O4C8H15 A3B4C8D15 -70.35 0.55 -10.17 -0.59 0
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150002 53789685 1 N3O5C8H13 A3B5C8D13 -140.96 1.9 -10.26 -1.16 0
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150003 53789687 2 O3C11H17 A3B11C17 -276.9 4.05 -9.5 -0.57 0
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150004 53789688 1 NOC6H7 ABC6D7 22.62 1.86 -9.18 -0.66 0
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150005 53789689 1 O3C45H80 A3B45C80 -284.58 2.96 -9.24 0.56 0
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150006 53789690 1 O3C45H80 A3B45C80 -288.79 2.32 -9.24 0.59 0
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150007 53789691 1 SN5O6C24H25 AB5C6D24E25 -157.22 9.97 -8.92 -1.39 0
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150008 53789692 1 NO2C11H23 AB2C11D23 -132.1 0.81 -9.49 1.99 0
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150009 53789693 1 N2O3C25H26 A2B3C25D26 18.99 1.76 -8.11 -0.32 0
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150010 53789694 1 O4C5H8 A4B5C8 -109.9 2.0 -10.65 -0.82 0
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150011 53789695 1 O7H10C14 A7B10C14 -238.34 5.35 -8.92 -1.26 0
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150012 53789696 1 N2O3C25H36 A2B3C25D36 -111.09 2.41 -8.37 -0.41 0
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150013 53789697 1 NC13H25 AB13C25 -7.3 2.49 -8.81 1.49 0
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150014 53789698 1 ClN4O5C29H41 AB4C5D29E41 -219.23 4.84 -9.48 -0.53 0
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150015 53789699 1 O2N3C7H7 A2B3C7D7 -37.14 6.12 -8.97 -0.63 0
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150016 53789700 1 Cl2O3H16C18 A2B3C16D18 -92.32 1.1 -9.21 -0.82 0
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150017 53789702 4 OC3H6 AB3C6 -111.31 2.39 -9.88 -0.56 0
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150018 53789703 1 SN3O3H17C22 AB3C3D17E22 60.45 8.97 -8.85 -1.21 0
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150019 53789704 1 N6O7C30H40 A6B7C30D40 -156.04 2.17 -9.32 -1.68 0
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150020 53789705 1 N2O3C25H32 A2B3C25D32 -96.5 3.11 -7.98 -0.27 0
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150021 53789706 1 O6C27H46 A6B27C46 -350.91 6.48 -9.81 0.78 0
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150022 53789707 1 NPSO5C26H34 ABCD5E26F34 -260.61 7.14 -8.43 -0.76 0
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150023 53789708 1 ClN4O6C34H45 AB4C6D34E45 -65.45 5.94 -9.32 -2.12 0
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150024 53789709 1 S3O7N9C25H35 A3B7C9D25E35 -167.58 10.4 -9.24 -1.16 0
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150025 53789710 1 SO2Cl4H10C14 AB2C4D10E14 -26.11 3.56 -9.83 -1.05 0
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150026 53789711 2 NOC2H5 ABC2D5 -13.5 1.86 -8.61 0.67 0
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150027 53789712 1 O3N4C15H36 A3B4C15D36 -154.25 3.27 -8.82 1.38 0
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150028 53789713 1 NO4C9H17 AB4C9D17 -190.68 2.89 -10.24 0.09 0
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150029 53789714 1 NO2C4H13 AB2C4D13 -112.03 2.25 -9.98 2.04 0
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150030 53789715 1 N9C13H25 A9B13C25 90.99 4.94 -8.05 -0.16 0