List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
275100 |
103813802 |
1 |
ON5C13H17 |
AB5C13D17 |
21.51 |
3.03 |
-9.69 |
-0.15 |
0 |
|
|
275101 |
103813812 |
1 |
ON5C12H21 |
AB5C12D21 |
-16.78 |
4.5 |
-9.02 |
0.05 |
0 |
|
|
275102 |
103813826 |
1 |
ON5C13H23 |
AB5C13D23 |
-24.23 |
4.16 |
-9.36 |
0.17 |
0 |
|
|
275103 |
103813828 |
1 |
ON5C13H23 |
AB5C13D23 |
-25.06 |
2.9 |
-9.51 |
0.01 |
0 |
|
|
275104 |
103813830 |
1 |
ON5C10H17 |
AB5C10D17 |
-7.81 |
5.14 |
-9.68 |
0.08 |
0 |
|
|
275105 |
103813835 |
1 |
ON5C8H15 |
AB5C8D15 |
-9.46 |
4.98 |
-9.81 |
0.11 |
0 |
|
|
275106 |
103813836 |
1 |
ON5C9H17 |
AB5C9D17 |
-13.94 |
4.85 |
-9.61 |
0.11 |
0 |
|
|
275107 |
103813838 |
1 |
ON5C15H19 |
AB5C15D19 |
21.21 |
4.16 |
-9.26 |
-0.01 |
0 |
|
|
275108 |
103813846 |
1 |
ON3C13H29 |
AB3C13D29 |
-86.54 |
4.6 |
-9.07 |
1.18 |
0 |
|
|
275109 |
103813848 |
1 |
ON3C12H27 |
AB3C12D27 |
-81.15 |
3.26 |
-8.76 |
1.04 |
0 |
|
|
275110 |
103813854 |
1 |
ON4C11H20 |
AB4C11D20 |
-35.52 |
5.02 |
-9.39 |
0.57 |
0 |
|
|
275111 |
103813867 |
1 |
ON5C15H23 |
AB5C15D23 |
-18.11 |
2.64 |
-8.89 |
-0.32 |
0 |
|
|
275112 |
103813871 |
1 |
ON3C13H25 |
AB3C13D25 |
-72.17 |
4.07 |
-8.85 |
1.04 |
0 |
|
|
275113 |
103813882 |
1 |
ON3C12H19 |
AB3C12D19 |
-43.65 |
2.13 |
-8.89 |
-0.2 |
0 |
|
|
275114 |
103813883 |
1 |
ON3C13H19 |
AB3C13D19 |
-28.64 |
4.66 |
-8.63 |
-0.05 |
0 |
|
|
275115 |
103813896 |
1 |
BrON3C11H14 |
ABC3D11E14 |
-24.47 |
7.78 |
-9.19 |
-0.64 |
0 |
|
|
275116 |
103813897 |
1 |
BrON3C10H14 |
ABC3D10E14 |
-25.79 |
8.72 |
-8.98 |
-0.46 |
0 |
|
|
275117 |
103813898 |
1 |
BrON4C12H17 |
ABC4D12E17 |
-20.76 |
4.54 |
-9.15 |
-0.66 |
0 |
|
|
275118 |
103813899 |
1 |
BrON3C14H14 |
ABC3D14E14 |
8.59 |
5.64 |
-9.25 |
-0.73 |
0 |
|
|
275119 |
103813900 |
1 |
BrOSN3C10H14 |
ABCD3E10F14 |
-21.04 |
5.79 |
-8.66 |
-0.66 |
0 |
|
|
275120 |
103813901 |
1 |
BrON3C14H14 |
ABC3D14E14 |
8.27 |
8.81 |
-9.0 |
-0.51 |
0 |
|
|
275121 |
103813902 |
1 |
BrON6C13H15 |
ABC6D13E15 |
38.74 |
8.75 |
-9.08 |
-0.87 |
0 |
|
|
275122 |
103813918 |
1 |
BrON3H14C15 |
ABC3D14E15 |
11.11 |
6.84 |
-9.18 |
-0.68 |
0 |
|
|
275123 |
103813919 |
1 |
BrON3C10H14 |
ABC3D10E14 |
-29.58 |
5.73 |
-9.3 |
-0.76 |
0 |
|
|
275124 |
103813922 |
1 |
BrON3C8H10 |
ABC3D8E10 |
-20.23 |
5.62 |
-9.31 |
-0.76 |
0 |
|
|
275125 |
103813927 |
1 |
BrON3C10H12 |
ABC3D10E12 |
-19.61 |
7.67 |
-9.04 |
-0.53 |
0 |
|
|
275126 |
103813928 |
1 |
BrON3C11H16 |
ABC3D11E16 |
-39.55 |
7.53 |
-9.14 |
-0.59 |
0 |
|
|
275127 |
103813930 |
1 |
BrON3C13H18 |
ABC3D13E18 |
-37.84 |
7.2 |
-9.07 |
-0.54 |
0 |
|
|
275128 |
103813931 |
1 |
BrO2N3H10C11 |
AB2C3D10E11 |
-15.06 |
7.89 |
-9.2 |
-1.04 |
0 |
|
|
275129 |
103813932 |
1 |
BrON3C12H18 |
ABC3D12E18 |
-38.15 |
6.43 |
-9.21 |
-0.67 |
0 |
|
|
275130 |
103813936 |
1 |
BrON3C12H16 |
ABC3D12E16 |
-31.94 |
4.17 |
-9.25 |
-0.72 |
0 |
|
|
275131 |
103813937 |
1 |
BrON3C8H10 |
ABC3D8E10 |
-20.1 |
5.85 |
-9.31 |
-0.77 |
0 |
|
|
275132 |
103813940 |
1 |
BrON3C10H14 |
ABC3D10E14 |
-31.25 |
7.16 |
-9.09 |
-0.57 |
0 |
|
|
275133 |
103813962 |
1 |
BrON3C8H10 |
ABC3D8E10 |
-17.15 |
7.55 |
-9.24 |
-0.69 |
0 |
|
|
275134 |
103813985 |
1 |
OSN3C14H17 |
ABC3D14E17 |
6.1 |
2.52 |
-8.57 |
-0.76 |
0 |
|
|
275135 |
103813995 |
1 |
OSN3C14H17 |
ABC3D14E17 |
-4.22 |
4.57 |
-8.56 |
-0.67 |
0 |
|
|
275136 |
103814001 |
1 |
OSN3C10H17 |
ABC3D10E17 |
-32.33 |
1.35 |
-9.55 |
-0.59 |
0 |
|
|
275137 |
103814006 |
1 |
SO2N3C11H17 |
AB2C3D11E17 |
-62.19 |
3.83 |
-9.16 |
-0.77 |
0 |
|
|
275138 |
103814013 |
1 |
OSN3C11H19 |
ABC3D11E19 |
-34.57 |
4.87 |
-9.45 |
-0.54 |
0 |
|
|
275139 |
103814038 |
1 |
ON3C11H21 |
AB3C11D21 |
-57.19 |
1.66 |
-8.94 |
0.95 |
0 |
|
|
275140 |
103814046 |
1 |
ON3C11H21 |
AB3C11D21 |
-41.89 |
5.83 |
-8.9 |
1.11 |
0 |
|
|
275141 |
103814057 |
1 |
ON3C13H25 |
AB3C13D25 |
-72.56 |
4.61 |
-8.75 |
1.19 |
0 |
|
|
275142 |
103814061 |
1 |
ON3C11H23 |
AB3C11D23 |
-65.69 |
2.46 |
-8.71 |
1.17 |
0 |
|
|
275143 |
103814065 |
1 |
ON3C11H21 |
AB3C11D21 |
-56.82 |
2.55 |
-8.66 |
1.07 |
0 |
|
|
275144 |
103814084 |
1 |
ON3C14H27 |
AB3C14D27 |
-73.19 |
5.01 |
-8.7 |
1.0 |
0 |
|
|
275145 |
103814100 |
1 |
ON3C12H23 |
AB3C12D23 |
-65.03 |
3.54 |
-8.52 |
1.15 |
0 |
|
|
275146 |
103814103 |
1 |
OSN3C12H19 |
ABC3D12E19 |
-41.13 |
1.56 |
-9.19 |
-0.42 |
0 |
|
|
275147 |
103814112 |
1 |
ON3C11H23 |
AB3C11D23 |
-59.89 |
3.79 |
-8.9 |
1.13 |
0 |
|
|
275148 |
103814118 |
1 |
ON3C12H25 |
AB3C12D25 |
-75.77 |
4.78 |
-8.98 |
1.13 |
0 |
|
|
275149 |
103814129 |
1 |
ON3C12H25 |
AB3C12D25 |
-70.28 |
5.12 |
-8.68 |
1.45 |
0 |