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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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25903 633049 2 BrNOH5C6 ABCD5E6 -16.92 2.94 -9.42 -0.95 0
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25904 633051 1 N2F3O3H13C19 A2B3C3D13E19 -114.25 4.58 -9.38 -1.57 0
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25905 633052 1 O7C20H22 A7B20C22 -245.95 4.06 -8.8 -0.71 0
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25906 633055 2 NO2H9C11 AB2C9D11 -96.4 4.77 -9.44 -1.24 0
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25907 633266 1 BrSiF5H12C15 ABC5D12E15 -212.37 3.33 -9.62 -1.25 0
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25908 633282 1 FON6C20H21 ABC6D20E21 10.53 3.87 -8.85 -0.34 0
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25909 633368 1 SN4H6O9C12 AB4C6D9E12 38.91 5.16 -10.11 -2.61 0
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25910 633440 1 O7H20C21 A7B20C21 -195.81 8.01 -8.97 -1.41 0
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25911 633477 1 NO5C22H27 AB5C22D27 -181.1 7.9 -8.35 -0.12 0
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25912 633479 1 NSiO2C24H37 ABC2D24E37 -78.57 0.93 -8.73 0.4 0
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25913 633507 1 O4N5C19H23 A4B5C19D23 -128.65 5.32 -9.05 -0.94 0
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25914 633535 1 O3C29H46 A3B29C46 -206.78 2.62 -9.49 0.9 0
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25915 633536 1 OSN4C21H30 ABC4D21E30 -28.01 2.99 -8.89 -0.8 0
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25916 633741 1 NO2C26H33 AB2C26D33 -85.55 3.9 -8.97 -0.03 0
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25917 633742 1 NSO4C21H29 ABC4D21E29 -187.45 6.28 -9.42 -0.67 0
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25918 633758 1 SN2O8H12C16 AB2C8D12E16 -125.4 5.83 -9.51 -2.12 0
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25919 633771 1 NSnO4C22H43 ABC4D22E43 -223.01 4.5 -9.65 0.44 0
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25920 633812 1 BrNO4C18H20 ABC4D18E20 -129.72 5.82 -9.12 -0.67 0
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25921 633837 1 OBr2N2H10C15 AB2C2D10E15 35.1 4.04 -9.52 -1.12 0
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25922 633843 1 N3O5C38H53 A3B5C38D53 -170.32 5.87 -9.14 -0.5 1
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25923 633854 1 ON5H22C24 AB5C22D24 145.29 7.07 0.0 0.0 0
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25924 633902 1 NH23C30 AB23C30 121.28 1.88 -9.02 -0.39 0
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25925 633964 1 O3H26C27 A3B26C27 -50.98 4.84 -8.0 -0.37 0
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25926 634002 1 CuN2O2C21H26 AB2C2D21E26 24.76 5.52 0.0 0.0 0
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25927 634091 1 FOC27H43 ABC27D43 -158.97 5.53 -9.8 0.02 0
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25928 634096 1 OC28H50 AB28C50 -135.6 1.48 -9.53 2.4 0
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25929 634130 1 N2O2H30C31 A2B2C30D31 -12.5 7.86 -8.48 -0.14 0
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25930 634224 1 N2S2Cl3O7H17C18 A2B2C3D7E17F18 -239.71 4.27 -9.23 -1.41 0
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25931 634238 1 N2O9C24H34 A2B9C24D34 -421.4 2.96 -10.37 -0.06 0
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25932 634276 1 NF2S2O4H13C18 AB2C2D4E13F18 -186.08 4.94 -8.74 -1.41 0
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25933 634279 1 SiO2C27H40 AB2C27D40 -160.55 1.86 -8.31 0.02 0
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25934 634290 1 N2O5C23H26 A2B5C23D26 -89.08 3.01 -8.48 -0.26 0
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25935 634298 1 N2O5C23H26 A2B5C23D26 -58.76 12.92 -8.34 -2.8 0
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25936 634302 1 O8H24C25 A8B24C25 -265.44 2.79 -8.43 -0.58 0
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25937 634303 1 OSi2C26H26 AB2C26D26 -43.35 0.68 -8.59 -0.36 0
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25938 634386 1 BrClNH19C22 ABCD19E22 76.84 2.93 -8.25 -0.34 0
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25939 634393 1 Si2O5C22H28 A2B5C22D28 -265.82 2.95 -9.2 -1.26 0
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25940 634397 4 NC7H9 AB7C9 97.8 2.73 -8.17 -0.2 0
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25941 634399 2 OC14H23 AB14C23 -161.35 3.25 -9.17 0.82 0
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25942 634419 1 SiO2C26H42 AB2C26D42 -179.03 2.34 -8.53 0.6 0
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25943 634473 2 OH12C15 AB12C15 12.22 1.39 -8.37 -0.68 0
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25944 634476 1 O7C23H28 A7B23C28 -232.01 1.64 -8.5 -0.15 0
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25945 634477 2 NOH10C14 ABC10D14 80.99 3.12 -8.54 -1.22 0
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25946 634496 1 NSO3C25H25 ABC3D25E25 -56.29 5.4 -9.5 -0.81 0
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25947 634541 2 NOH12C14 ABC12D14 60.96 3.2 -8.49 -0.6 0
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25948 634542 2 NOH12C14 ABC12D14 66.71 3.46 -8.45 -0.96 0
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25949 634543 1 NO9H17C23 AB9C17D23 -275.24 5.25 -9.34 -2.02 -5
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25951 634610 1 NOC30H49 ABC30D49 -69.58 3.95 -9.07 1.2 -5
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25952 634715 1 CoO2H21C31 AB2C21D31 121.06 43.28 -9.96 -5.65 0
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25953 634837 2 O4C15H15 A4B15C15 -258.38 5.08 -8.08 -0.59 0