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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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408972 135081745 1 ZrCl2H18C21 AB2C18D21 245.76 6.81 -5.49 -4.07 0
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408973 135081746 3 H6C7 A6B7 111.28 0.55 -8.86 -0.68 -1
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408975 135081748 1 ClNOC24H32 ABCD24E32 -47.06 5.2 -8.22 -0.82 0
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408976 135081749 1 ZrCl2C29H34 AB2C29D34 9.33 4.1 -7.75 -1.98 0
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408977 135081750 1 C29H34 A29B34 73.03 1.53 -8.61 -0.52 -1
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408978 135081751 1 FNNiOPC48H52 ABCDEF48G52 171.6 1.94 0.0 0.0 0
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408979 135081752 1 FNOC24H32 ABCD24E32 -68.62 4.15 -8.18 -0.68 0
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408980 135081753 1 ZrCl2H22C28 AB2C22D28 76.19 4.2 -7.85 -2.41 0
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408981 135081754 2 H11C14 A11B14 145.76 0.77 -8.91 -0.3 0
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408982 135081755 1 ZrCl2C26H28 AB2C26D28 -3.46 3.32 -6.37 -2.11 0
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408983 135081756 2 C13H14 A13B14 64.87 1.06 -8.36 -0.48 0
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408984 135081757 1 BNPtS2P3O5F10C39H39 ABCD2E3F5G10H39I39 -614.72 6.32 -8.6 -2.02 0
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408985 135081758 1 ZrCl2C30H36 AB2C30D36 -32.88 4.01 -6.81 -2.34 0
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408986 135081759 6 C5H6 A5B6 86.4 2.01 -7.26 -1.47 0
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408987 135081760 1 ZrCl2H28C34 AB2C28D34 223.04 5.89 -6.87 -1.69 0
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408988 135081761 1 TiC32H52 AB32C52 136.71 6.68 -7.78 -3.26 0
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408989 135081762 1 PtP2C18H38 AB2C18D38 7.69 2.52 -8.31 -0.43 0
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408991 135081764 1 HN2C3F6 AB2C3D6 -260.41 1.96 0.0 0.0 1
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408994 135081767 1 PN2C7H18 AB2C7D18 3.27 2.56 0.0 0.0 -1
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408995 135081768 1 PH2O5Cl12C19 AB2C5D12E19 -234.44 4.81 0.0 0.0 0
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408996 135081769 1 FeP5C10H20 AB5C10D20 -257.51 3.23 0.0 0.0 0
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408997 135081770 1 SbC2H2N2Cl7 AB2C2D2E7 -43.93 14.1 -11.46 -3.46 1
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408998 135081771 1 ClC2H2N2 AB2C2D2 63.93 1.63 0.0 0.0 0
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408999 135081772 1 SbN2C6Cl7H10 AB2C6D7E10 -79.54 15.64 -11.3 -3.22 0
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409000 135081773 1 OSbN2Cl6C7H13 ABC2D6E7F13 -125.11 15.24 -11.29 -2.43 1
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409001 135081774 1 ON2C7H13 AB2C7D13 3.05 4.53 0.0 0.0 0
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409002 135081775 1 OSbN2Cl7H8C9 ABC2D7E8F9 -69.83 19.19 -10.26 -3.27 1
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409003 135081776 1 ClON2H8C9 ABC2D8E9 42.78 4.24 0.0 0.0 0
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409004 135081777 1 ClNSnC8H14 ABCD8E14 -7.55 4.28 -10.06 -0.12 0
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409005 135081778 1 NO3C11H20 AB3C11D20 -128.71 4.03 0.0 0.0 0
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409006 135081779 1 NO4C23H34 AB4C23D34 -199.84 2.26 0.0 0.0 0
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409007 135081780 1 LiN2O2C11H19 AB2C2D11E19 -73.05 6.73 -7.45 2.02 0
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409008 135081781 1 N2O2C11H20 A2B2C11D20 -64.8 1.88 -7.83 1.44 0
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409009 135081782 1 S5H6C9 A5B6C9 63.01 2.99 -8.38 -1.83 0
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409010 135081784 1 FO4N5C36H46 AB4C5D36E46 -176.27 5.65 -9.13 -0.2 0
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409011 135081785 1 FO4N5C36H46 AB4C5D36E46 -176.96 3.63 -9.12 -0.19 0
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409012 135081786 1 O4N5C36H47 A4B5C36D47 -130.23 6.17 -9.16 -0.18 0
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409013 135081787 1 FO4N5C36H46 AB4C5D36E46 -177.69 5.48 -9.06 -0.14 0
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409014 135081788 1 FO4N5C36H46 AB4C5D36E46 -180.89 4.91 -9.05 -0.17 0
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409015 135081789 1 BrO3C17H23 AB3C17D23 -78.59 2.94 -9.66 -0.18 0
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409016 135081790 1 ClO9C21H25 AB9C21D25 -373.83 7.73 -10.38 -1.17 0
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409017 135081791 1 PN3H4C5 AB3C4D5 57.35 2.31 -9.4 -1.19 -1
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409018 135081792 1 AsC2H2P2 AB2C2D2 107.14 1.0 0.0 0.0 -1
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409019 135081793 1 AsC2H2P2 AB2C2D2 91.58 1.9 0.0 0.0 0
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409020 135081794 1 ClNO5H28C30 ABC5D28E30 60.94 10.08 -8.45 -2.08 1
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409021 135081795 1 NOH28C30 ABC28D30 65.01 3.28 0.0 0.0 0
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409022 135081796 1 NOPSC18H26 ABCDE18F26 -50.72 16.58 -8.08 -1.22 0
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409023 135081797 1 O5Br6C18H18 A5B6C18D18 -155.5 6.56 -10.28 -2.0 0
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409024 135081798 1 CuN2O2Sb2F12C17H30 AB2C2D2E12F17G30 -673.39 25.35 0.0 0.0 0
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409027 135081801 1 OS2H20C24 AB2C20D24 36.77 5.48 -8.5 -1.15 -2