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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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230676 87571637 1 N2O2H16C17 A2B2C16D17 -13.84 5.45 -9.36 -0.43 0
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230677 87571638 2 O2C13H26 A2B13C26 -278.61 10.78 -10.38 -0.12 0
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230678 87571640 1 ClO3N9C24H30 AB3C9D24E30 -34.67 14.93 -9.3 -1.01 0
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230679 87571641 1 O6C15H26 A6B15C26 -268.22 7.0 -9.84 -0.42 0
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230680 87571648 1 N2O8C27H42 A2B8C27D42 -330.49 2.83 -9.33 -1.79 0
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230681 87571649 1 N2O4C23H38 A2B4C23D38 -182.5 1.74 -9.37 0.55 0
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230683 87571652 1 ClO2N8C26H31 AB2C8D26E31 12.52 9.6 -9.27 -0.99 0
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230684 87571653 2 NOC26H50 ABC26D50 -259.44 7.29 -9.53 1.17 0
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230685 87571655 1 FN2O10C25H35 AB2C10D25E35 -456.05 3.62 -8.65 -0.18 0
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230686 87571658 1 SiO3C11H24 AB3C11D24 -240.39 2.14 -9.51 0.75 0
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230687 87571659 1 BrFN2O7C48H50 ABC2D7E48F50 -192.9 6.02 -8.86 -0.31 0
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230688 87571660 1 FSN3O3H16C18 ABC3D3E16F18 -96.87 7.19 -9.65 -1.84 0
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230690 87571665 1 ClPC5O6H8 ABC5D6E8 -296.54 2.86 -10.99 -0.88 0
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230691 87571667 1 NOF6H13C14 ABC6D13E14 -332.47 5.79 -10.03 -1.06 0
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230692 87571669 1 I2O2C11H24 A2B2C11D24 -119.91 3.04 -9.87 -1.34 0
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230693 87571670 1 OI2C7H14 AB2C7D14 -46.69 3.35 -9.63 -1.08 0
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230694 87571672 1 NO2C21H43 AB2C21D43 -184.05 7.0 -10.33 0.94 0
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230695 87571676 1 NNaO2C21H43 ABC2D21E43 -123.93 1.35 0.0 0.0 0
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230696 87571680 1 Si2O3C16H32 A2B3C16D32 -229.15 6.67 -7.86 0.07 0
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230697 87571683 1 BrNO3C7H12 ABC3D7E12 -147.9 4.26 -9.54 -0.93 0
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230698 87571684 1 N2O3C16H16 A2B3C16D16 -47.04 6.47 -8.37 -1.21 0
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230699 87571685 1 O6Si9C44H49 A6B9C44D49 -242.86 1.27 0.0 0.0 1
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230700 87571686 1 SO2N5C27H28 AB2C5D27E28 82.73 7.87 0.0 0.0 0
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230701 87571687 1 PN2O3C19H31 AB2C3D19E31 -167.3 4.46 -8.38 0.07 0
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230702 87571688 1 FN2O12C31H41 AB2C12D31E41 -558.97 2.86 -8.54 0.17 -1
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230703 87571691 1 N3O3C7H10 A3B3C7D10 -47.15 4.4 0.0 0.0 0
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230704 87571697 1 SO5C6H14 AB5C6D14 -147.99 6.92 -10.37 -0.29 0
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230705 87571698 1 F2N2O8C49H52 A2B2C8D49E52 -285.29 4.17 -8.66 -0.18 0
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230706 87571699 1 F2N2O8C21H28 A2B2C8D21E28 -400.72 4.1 -8.85 0.03 0
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230707 87571700 1 NO3C10H11 AB3C10D11 -116.42 3.47 -8.67 -0.55 0
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230708 87571701 1 ClN2O10C21H31 AB2C10D21E31 -190.09 17.59 -10.56 -2.72 0
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230709 87571707 1 N2O2C17H20 A2B2C17D20 -22.47 0.79 -9.4 0.04 0
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230710 87571709 1 NOC15H23 ABC15D23 -31.11 2.95 -8.84 0.23 0
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230711 87571710 1 NSi2C14H33 AB2C14D33 -86.02 1.05 -7.39 0.44 0
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230712 87571715 1 NSi2C14H31 AB2C14D31 -7.89 3.31 -7.13 -1.06 0
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230713 87571716 1 OCl2N5C21H27 AB2C5D21E27 4.23 7.44 -8.74 -0.12 0
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230714 87571717 1 NSi2C17H39 AB2C17D39 -104.41 0.86 -7.58 0.41 0
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230715 87571718 1 NSi2C17H39 AB2C17D39 -95.63 1.2 -8.17 0.77 0
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230716 87571719 1 NSi2C17H37 AB2C17D37 -23.57 1.27 -6.3 -0.62 0
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230717 87571721 1 NSi2C17H38 AB2C17D38 -52.52 2.17 0.0 0.0 0
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230720 87571731 1 PC36H75 AB36C75 -171.72 2.13 -8.89 2.96 0
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230721 87571737 1 O10C113H202 A10B113C202 -739.02 4.38 -9.25 0.26 0
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230722 87571742 1 O4N5C30H39 A4B5C30D39 -66.52 5.42 -8.13 -0.44 0
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230723 87571744 2 NOC7H12 ABC7D12 -97.62 4.42 -9.51 0.08 0
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230724 87571745 1 NCl2O2C6H11 AB2C2D6E11 -132.0 4.07 -10.44 -0.27 0
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230725 87571753 1 Cl3O4S4N6F7H40C44 A3B4C4D6E7F40G44 -393.33 7.41 -8.6 -1.59 0
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230726 87571754 1 N4O4C29H40 A4B4C29D40 -117.51 2.71 -9.1 0.24 -2
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230728 87571760 1 SN6O10C30H44 AB6C10D30E44 -368.07 7.09 -8.64 -0.67 0
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230729 87571761 1 BrN5C19H20 AB5C19D20 94.31 2.31 -8.12 -0.33 0
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230730 87571767 1 ON2F6C17H18 AB2C6D17E18 -322.5 6.0 -8.99 -0.84 0