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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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31926 3723586 1 ClFNH3C7 ABCD3E7 2.15 4.17 -10.13 -1.3 0
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31927 3723592 1 FNSO4C12H14 ABCD4E12F14 -178.95 2.61 -10.06 -0.86 0
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31928 3723602 1 OCl2N2C17H18 AB2C2D17E18 -17.61 3.6 -8.24 -1.0 0
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31929 3723613 1 OSN2F3H11C13 ABC2D3E11F13 -157.78 4.59 -9.14 -1.39 0
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31930 3723615 1 FSN2O3H17C25 ABC2D3E17F25 -47.32 8.59 -8.76 -1.19 0
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31931 3723874 1 N2O2C27H28 A2B2C27D28 -38.56 5.39 -8.0 -0.29 0
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31932 3724042 1 NO2C14H15 AB2C14D15 -54.91 7.72 -8.8 0.07 1
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31933 3724222 1 N2C30H31 A2B30C31 90.81 4.08 0.0 0.0 0
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31934 3724223 1 OS2H12C17 AB2C12D17 37.02 4.98 -8.55 -1.05 0
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31935 3724224 1 BrN2O2C15H15 AB2C2D15E15 -32.69 1.52 -9.57 -0.35 0
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31936 3724242 1 N3O4C26H29 A3B4C26D29 -105.07 3.54 -8.41 -0.18 0
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31937 3724265 1 ON2C14H22 AB2C14D22 -15.15 5.38 -9.28 0.55 0
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31938 3724266 1 NSO3C22H33 ABC3D22E33 -174.54 1.66 -8.43 -0.54 0
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31939 3724267 1 NOC19H23 ABC19D23 -20.77 3.58 -9.34 0.24 0
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31940 3724270 1 N2O3H16C23 A2B3C16D23 68.07 0.93 -9.24 -1.8 0
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31941 3724271 1 OCl2N5H13C20 AB2C5D13E20 94.99 9.45 -8.9 -1.67 0
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31942 3724278 1 N4O5C12H18 A4B5C12D18 -97.25 6.73 -8.75 -1.5 0
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31943 3724289 1 NCl2O2H15C18 AB2C2D15E18 -34.99 3.59 -8.61 -0.74 0
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31944 3724297 1 FO2N3C24H24 AB2C3D24E24 -84.2 9.97 -8.61 -0.67 0
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31945 3724300 1 Cl2O2N3H15C23 A2B2C3D15E23 40.45 7.96 -9.11 -1.15 0
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31946 3724304 1 ON7C25H29 AB7C25D29 62.9 5.91 -9.47 -1.24 0
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31947 3724306 1 ON8H20C23 AB8C20D23 142.3 5.06 -9.57 -1.35 0
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31948 3724309 1 ON6C23H24 AB6C23D24 87.5 3.5 -9.43 -1.16 0
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31949 3724331 1 N3O4C26H27 A3B4C26D27 -84.62 3.04 -8.67 -0.38 0
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31950 3724341 1 N2O2C19H24 A2B2C19D24 -69.79 3.07 -8.33 0.17 0
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31951 3724742 1 FSN4O4H19C27 ABC4D4E19F27 -21.49 6.05 -8.34 -2.11 0
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31952 3724785 1 SN2O4H22C23 AB2C4D22E23 -83.32 1.07 -8.96 -1.1 0
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31953 3724791 1 O3N4H14C15 A3B4C14D15 -50.89 2.43 -9.13 -1.1 0
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31954 3724908 1 BrSN2C9H9 ABC2D9E9 32.97 2.44 -8.83 -0.66 0
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31955 3725216 2 NO2H15C17 AB2C15D17 -45.54 9.12 -8.51 -0.4 0
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31956 3725302 1 NPO4C22H40 ABC4D22E40 -269.16 4.79 -8.44 0.48 0
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31957 3725303 1 SN3O3C15H19 AB3C3D15E19 -98.87 5.33 -9.64 -1.09 0
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31958 3725304 1 NC20H31 AB20C31 -51.4 1.32 -8.5 3.1 0
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31959 3725305 1 NO2C12H19 AB2C12D19 -122.75 3.22 -10.08 0.88 0
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31960 3725306 1 NCl2C18H23 AB2C18D23 -29.11 2.56 -9.28 -0.37 0
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31961 3725635 1 SF2N4O4C24H30 AB2C4D4E24F30 -187.02 5.04 -8.52 -0.5 0
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31962 3725636 1 OS2N4C22H28 AB2C4D22E28 15.49 5.73 -8.5 -0.49 0
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31963 3725656 1 ClON2H23C25 ABC2D23E25 30.62 2.35 -8.85 -1.07 0
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31964 3725688 1 BrSO2N4H23C25 ABC2D4E23F25 33.86 3.89 -8.76 -0.56 0
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31965 3725848 1 N3O5H27C30 A3B5C27D30 -99.74 2.87 -8.45 -0.25 0
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31966 3725903 1 BrSN3H10C13 ABC3D10E13 91.6 4.47 -8.95 -0.76 0
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31967 3725944 1 SO2N3C23H23 AB2C3D23E23 -4.94 4.07 -8.64 -0.58 0
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31968 3726011 1 BrNO3C20H20 ABC3D20E20 -98.42 2.44 -8.94 -0.63 0
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31969 3726039 2 O3N4H8C9 A3B4C8D9 -139.92 5.72 -9.19 -1.96 0
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31970 3726094 1 ClO2N3C17H20 AB2C3D17E20 -25.12 4.68 -9.46 -0.76 0
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31971 3726099 1 BrNO2H18C23 ABC2D18E23 45.83 2.92 -8.69 -0.89 0
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31972 3726119 1 ClSN2C17H17 ABC2D17E17 35.51 3.57 -8.5 -0.28 0
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31973 3726120 1 SCl2N2H16C17 AB2C2D16E17 29.04 4.7 -8.63 -0.73 0
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31974 3726532 1 BrON2F3C20H22 ABC2D3E20F22 -149.56 7.71 -8.96 -0.51 0
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31975 3726536 2 NC8H13 AB8C13 0.86 2.18 -8.71 0.47 0