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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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658 3154 1 N2S3O4C10H16 A2B3C4D10E16 -133.16 4.69 -9.45 -1.43 0
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659 3155 1 NSC19H21 ABC19D21 55.23 1.57 -8.32 -0.08 0
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660 3157 1 N5O5C23H25 A5B5C23D25 -102.85 8.27 -8.43 -0.66 0
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661 3159 1 FN2O5C9H11 AB2C5D9E11 -251.32 4.16 -10.22 -1.1 0
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662 3160 1 NO11C27H31 AB11C27D31 -415.1 5.54 -8.72 -1.4 0
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663 3162 1 ON2C17H22 AB2C17D22 10.19 1.19 -8.82 -0.13 0
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664 3163 1 N5O6C27H31 A5B6C27D31 -153.26 2.81 -8.69 -0.52 0
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665 3164 2 NOC9H13 ABC9D13 -78.68 3.97 -8.62 -0.48 0
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666 3165 2 ClNO2C6H6 ABC2D6E6 -138.49 3.14 -9.4 -1.01 0
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667 3166 1 NO2C20H31 AB2C20D31 -102.73 2.11 -8.62 0.18 0
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668 3167 2 OC10H16 AB10C16 -149.44 2.34 -9.75 0.73 0
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669 3170 1 O3C23H36 A3B23C36 -190.82 1.89 -9.67 0.8 0
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670 3171 1 NO5C9H11 AB5C9D11 -193.77 5.7 -9.13 -0.53 0
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671 3172 1 BrClNC11H15 ABCD11E15 5.32 2.11 -9.11 -0.16 0
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672 3173 1 NNa2O2S2C4H5 AB2C2D2E4F5 -156.37 2.73 -7.86 -0.18 0
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673 3175 1 N3O8C26H27 A3B8C26D27 -239.47 3.52 -8.31 -1.01 0
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674 3176 1 N3O7C25H25 A3B7C25D25 -197.27 3.7 -8.18 -0.87 0
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675 3178 1 O3N4C26H27 A3B4C26D27 -27.43 7.53 0.0 0.0 1
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676 3179 1 O3N4C26H26 A3B4C26D26 -22.0 6.55 -8.55 -0.7 0
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677 3180 1 NO2C18H27 AB2C18D27 -85.76 5.05 -8.62 -0.33 0
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678 3181 1 O2C21H28 A2B21C28 -41.66 8.27 -8.3 -0.47 0
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679 3183 1 BrN2O5C11H13 AB2C5D11E13 -196.34 6.56 -9.2 -0.85 0
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680 3184 1 SN3O3C21H29 AB3C3D21E29 -20.68 21.68 -4.13 -1.4 2
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681 3185 1 SN3O3C21H27 AB3C3D21E27 -83.67 5.04 -8.65 -0.52 0
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682 3188 1 N2O5C15H26 A2B5C15D26 -222.65 1.42 -9.75 -0.68 0
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683 3189 1 N2O5C17H30 A2B5C17D30 -228.91 4.6 -9.6 -0.38 0
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684 3190 1 N3O9H43C44 A3B9C43D44 -134.87 10.82 -8.46 -1.7 0
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685 3193 1 O4C21H36 A4B21C36 -209.58 3.92 -9.41 0.5 0
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686 3194 1 NOSeH9C13 ABCD9E13 34.27 3.75 -8.37 -1.32 0
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687 3196 1 SO5C20H28 AB5C20D28 -241.85 8.9 -9.68 -0.51 0
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688 3197 1 S2N12O12C51H64 A2B12C12D51E64 -365.17 12.71 -8.13 -1.77 0
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689 3204 1 PN2O7C35H39 AB2C7D35E39 -211.85 6.93 -8.25 -1.06 0
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690 3205 1 SN4O6C22H30 AB4C6D22E30 -202.36 4.33 -9.52 -1.14 0
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691 3206 1 ON5C14H23 AB5C14D23 -20.24 1.05 -9.02 -0.46 0
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692 3207 2 OC10H18 AB10C18 -135.36 5.28 -9.66 0.71 0
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693 3210 2 OC10H17 AB10C17 -112.43 5.04 -9.42 0.58 0
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694 3211 1 O7N8C21H36 A7B8C21D36 -317.54 4.43 -9.59 -0.2 0
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695 3212 2 H3O4C7 A3B4C7 -214.32 12.12 -8.38 -2.45 0
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696 3213 1 N2H14C17 A2B14C17 63.41 3.56 -8.12 -0.78 0
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697 3215 1 O45C96H152 A45B96C152 -2051.51 5.67 -9.66 -0.71 0
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699 3217 2 O23C48H76 A23B48C76 -2077.15 15.17 -8.96 -0.58 0
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700 3218 1 O4C17H26 A4B17C26 -173.51 1.66 -9.98 -1.99 0
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701 3220 5 OH2C3 AB2C3 -160.48 2.43 -9.36 -1.76 0
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702 3221 1 N3O3C11H17 A3B3C11D17 -80.04 0.65 -8.59 -0.58 0
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703 3222 1 N2O5C20H28 A2B5C20D28 -221.3 4.11 -9.56 0.1 0
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704 3223 1 SN3O7C41H43 AB3C7D41E43 -159.92 6.56 -8.7 -0.83 0
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705 3226 1 ClOH2C3F5 ABC2D3E5 -320.37 0.54 -11.66 -0.6 0
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706 3227 3 NO3C11H19 AB3C11D19 -456.26 5.82 -9.5 0.12 0
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707 3229 1 FO3N4C15H17 AB3C4D15E17 -124.56 11.84 -9.26 -1.16 0
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708 3232 1 O3C20H28 A3B20C28 -146.92 3.08 -9.7 -0.1 0