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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