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Record Count: 438090
Id Cidd Fcv Redu Stoi Heat Of Formation Dipole Homo Lumo Charge
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71927 48415626 1 O2N3C22H27 A2B3C22D27 -36.8 2.51 -8.68 -0.12 0
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71928 48415627 1 O2N5H21C22 A2B5C21D22 45.26 3.74 -8.92 -1.23 0
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71929 48415628 1 O2N5C22H23 A2B5C22D23 39.37 3.62 -8.96 -0.73 0
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71930 48415630 2 ClON2C10H10 ABC2D10E10 -38.58 4.93 -9.16 -0.84 0
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71931 48415631 2 ON2C11H13 AB2C11D13 -41.51 3.48 -8.87 -0.06 0
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71932 48415632 1 SO3N5C19H21 AB3C5D19E21 -39.47 7.26 -8.93 -0.72 0
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71933 48415633 1 ON4H20C21 AB4C20D21 45.48 9.39 -8.51 -1.24 0
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71934 48415634 1 N3O3C21H23 A3B3C21D23 -54.71 3.72 -9.01 -0.31 0
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71935 48415635 1 O3N5C22H29 A3B5C22D29 -102.37 5.02 -9.0 -0.18 0
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71936 48415636 1 ON7C21H25 AB7C21D25 59.25 7.99 -9.16 -0.84 0
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71937 48415637 1 SO2N4H22C23 AB2C4D22E23 12.13 6.48 -8.99 -1.04 0
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71938 48415638 1 ClO2N3H20C21 AB2C3D20E21 -9.5 2.32 -9.06 -1.15 0
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71939 48415639 1 O3N4C20H20 A3B4C20D20 -56.15 5.89 -8.65 -0.9 0
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71940 48415640 1 O3N5C19H21 A3B5C19D21 8.09 7.85 -9.09 -1.01 0
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71941 48415641 1 O3N4C23H24 A3B4C23D24 -63.5 5.48 -9.14 -0.93 0
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71942 48415642 1 FON3C20H22 ABC3D20E22 -38.67 7.78 -8.94 -0.12 0
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71943 48415643 1 OCl2N3C16H19 AB2C3D16E19 -9.93 1.53 -8.98 -0.16 0
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71944 48415644 1 ON4C19H22 AB4C19D22 18.67 5.2 -9.09 -0.27 0
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71945 48415645 1 OS2N3C22H25 AB2C3D22E25 19.66 2.09 -8.71 -0.39 0
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71946 48415646 1 SO2N4C21H26 AB2C4D21E26 -33.55 3.93 -8.96 -0.87 0
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71947 48415647 1 SO2N4H22C23 AB2C4D22E23 13.86 7.87 -9.03 -1.05 0
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71948 48415648 1 SO2N4C22H26 AB2C4D22E26 -24.15 6.87 -9.18 -0.41 0
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71949 48415649 1 SO2N4C21H22 AB2C4D21E22 -14.56 2.77 -8.5 -0.35 0
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71950 48415650 1 OF2N3H17C18 AB2C3D17E18 -75.58 6.81 -8.65 -1.07 0
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71951 48415651 1 SO2N4C20H24 AB2C4D20E24 -26.21 3.52 -8.95 -0.63 0