List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
253100 |
103116044 |
1 |
ON6C14H18 |
AB6C14D18 |
41.77 |
3.71 |
-8.12 |
-0.03 |
0 |
|
|
253101 |
103116052 |
1 |
O2N4C13H16 |
A2B4C13D16 |
-13.88 |
4.94 |
-8.6 |
0.05 |
0 |
|
|
253102 |
103116061 |
1 |
O2N5C13H19 |
A2B5C13D19 |
-21.23 |
6.08 |
-9.65 |
-1.03 |
0 |
|
|
253103 |
103116062 |
1 |
O3N4C13H14 |
A3B4C13D14 |
-44.6 |
4.59 |
-7.91 |
-0.12 |
0 |
|
|
253104 |
103116065 |
1 |
O2N6C11H16 |
A2B6C11D16 |
4.42 |
4.84 |
-9.05 |
-1.05 |
0 |
|
|
253105 |
103116070 |
1 |
O3N6C11H14 |
A3B6C11D14 |
-41.31 |
5.98 |
-9.94 |
-1.31 |
0 |
|
|
253106 |
103116075 |
1 |
O3N6C12H16 |
A3B6C12D16 |
-47.09 |
8.78 |
-9.71 |
-1.09 |
0 |
|
|
253107 |
103116077 |
1 |
O2N5H13C14 |
A2B5C13D14 |
15.08 |
4.24 |
-8.44 |
-1.12 |
0 |
|
|
253108 |
103116080 |
1 |
ClON5H10C13 |
ABC5D10E13 |
51.32 |
0.83 |
-8.53 |
-1.47 |
0 |
|
|
253109 |
103116088 |
1 |
OSN4C14H18 |
ABC4D14E18 |
14.28 |
7.14 |
-8.05 |
-0.21 |
0 |
|
|
253110 |
103116093 |
1 |
ON4C14H18 |
AB4C14D18 |
18.69 |
4.86 |
-8.38 |
0.27 |
0 |
|
|
253111 |
103116104 |
1 |
OF2N5H9C13 |
AB2C5D9E13 |
-28.49 |
2.61 |
-8.66 |
-1.48 |
0 |
|
|
253112 |
103116114 |
1 |
ON5H13C14 |
AB5C13D14 |
57.88 |
3.92 |
-8.63 |
-1.15 |
0 |
|
|
253113 |
103116121 |
1 |
O4N5C11H15 |
A4B5C11D15 |
-85.68 |
5.05 |
-9.69 |
-1.08 |
0 |
|
|
253114 |
103116122 |
1 |
OSN4C13H14 |
ABC4D13E14 |
29.82 |
5.27 |
-7.83 |
0.12 |
0 |
|
|
253115 |
103116131 |
1 |
O3N7C11H11 |
A3B7C11D11 |
19.55 |
4.99 |
-9.91 |
-1.42 |
0 |
|
|
253116 |
103116135 |
1 |
O3N6C12H16 |
A3B6C12D16 |
-46.51 |
8.23 |
-9.98 |
-1.08 |
0 |
|
|
253117 |
103116140 |
1 |
O2N7C12H13 |
A2B7C12D13 |
41.5 |
5.21 |
-9.4 |
-1.29 |
0 |
|
|
253118 |
103116141 |
1 |
O3N5C10H13 |
A3B5C10D13 |
-34.72 |
6.22 |
-9.69 |
-1.14 |
0 |
|
|
253119 |
103116150 |
1 |
FON4H11C14 |
ABC4D11E14 |
0.96 |
2.23 |
-8.24 |
-0.93 |
0 |
|
|
253120 |
103116151 |
1 |
FON4C11H11 |
ABC4D11E11 |
-18.43 |
5.99 |
-8.15 |
-0.06 |
0 |
|
|
253121 |
103116164 |
1 |
ON5H13C14 |
AB5C13D14 |
59.93 |
4.5 |
-8.67 |
-1.25 |
0 |
|
|
253122 |
103116186 |
1 |
ON4C12H14 |
AB4C12D14 |
21.53 |
7.15 |
-8.46 |
0.13 |
0 |
|
|
253123 |
103116194 |
1 |
O3N4C12H12 |
A3B4C12D12 |
-57.25 |
3.92 |
-8.45 |
-0.69 |
0 |
|
|
253124 |
103116197 |
1 |
O3N4C12H12 |
A3B4C12D12 |
-55.96 |
10.62 |
-8.67 |
-0.78 |
0 |
|
|
253125 |
103116200 |
1 |
O3N4C13H14 |
A3B4C13D14 |
-55.22 |
9.11 |
-8.58 |
-0.19 |
0 |
|
|
253126 |
103116205 |
1 |
ON4C13H16 |
AB4C13D16 |
21.79 |
6.89 |
-8.27 |
0.36 |
0 |
|
|
253127 |
103116207 |
1 |
O2N5C12H17 |
A2B5C12D17 |
-17.22 |
6.1 |
-9.63 |
-1.03 |
0 |
|
|
253128 |
103116218 |
1 |
ON4H14C16 |
AB4C14D16 |
49.83 |
6.03 |
-8.4 |
-0.98 |
0 |
|
|
253129 |
103116228 |
1 |
ON4C13H14 |
AB4C13D14 |
29.89 |
5.45 |
-8.4 |
0.21 |
0 |
|
|
253130 |
103116232 |
1 |
O2N5C13H19 |
A2B5C13D19 |
-24.23 |
5.65 |
-9.66 |
-1.0 |
0 |
|
|
253131 |
103116234 |
1 |
O3N5C13H17 |
A3B5C13D17 |
-57.18 |
7.42 |
-9.46 |
-0.81 |
0 |
|
|
253132 |
103116247 |
1 |
ON6C9H12 |
AB6C9D12 |
50.3 |
8.43 |
-8.0 |
-0.28 |
0 |
|
|
253133 |
103116253 |
1 |
ON6C9H12 |
AB6C9D12 |
46.46 |
5.29 |
-8.39 |
0.18 |
0 |
|
|
253134 |
103116259 |
1 |
OF2N5H9C13 |
AB2C5D9E13 |
-31.85 |
3.15 |
-8.92 |
-1.43 |
0 |
|
|
253135 |
103116262 |
1 |
FON5H10C13 |
ABC5D10E13 |
18.51 |
1.76 |
-8.65 |
-1.52 |
0 |
|
|
253136 |
103116267 |
1 |
BrON4H11C14 |
ABC4D11E14 |
41.94 |
3.55 |
-8.48 |
-1.03 |
0 |
|
|
253137 |
103116269 |
1 |
FON5H10C13 |
ABC5D10E13 |
17.93 |
5.63 |
-9.02 |
-1.48 |
0 |
|
|
253138 |
103116270 |
1 |
FON4C11H11 |
ABC4D11E11 |
-20.61 |
5.92 |
-8.27 |
-0.35 |
0 |
|
|
253139 |
103116274 |
1 |
ON6C10H14 |
AB6C10D14 |
44.71 |
6.35 |
-8.27 |
-0.09 |
0 |
|
|
253140 |
103116279 |
1 |
BrON5H10C13 |
ABC5D10E13 |
63.14 |
5.05 |
-8.3 |
-1.48 |
0 |
|
|
253141 |
103116282 |
1 |
BrON4H13C15 |
ABC4D13E15 |
42.31 |
6.37 |
-8.1 |
-0.71 |
0 |
|
|
253142 |
103116284 |
1 |
ClON4H11C14 |
ABC4D11E14 |
38.34 |
3.17 |
-8.14 |
-1.02 |
0 |
|
|
253143 |
103116295 |
1 |
O3N5C11H15 |
A3B5C11D15 |
-57.73 |
3.7 |
-9.72 |
-1.1 |
0 |
|
|
253144 |
103116300 |
1 |
ON6H10C12 |
AB6C10D12 |
74.14 |
0.73 |
-8.55 |
-1.39 |
0 |
|
|
253145 |
103116307 |
1 |
ClON4C12H13 |
ABC4D12E13 |
7.83 |
7.83 |
-8.01 |
-0.18 |
0 |
|
|
253146 |
103116310 |
1 |
ON4C16H16 |
AB4C16D16 |
31.09 |
4.58 |
-8.01 |
-1.02 |
0 |
|
|
253147 |
103116325 |
1 |
O3N5C10H13 |
A3B5C10D13 |
-47.14 |
5.17 |
-9.8 |
-1.22 |
0 |
|
|
253148 |
103116328 |
1 |
O2N5C12H17 |
A2B5C12D17 |
-17.94 |
5.82 |
-9.62 |
-0.96 |
0 |
|
|
253149 |
103116342 |
1 |
N3O3C11H17 |
A3B3C11D17 |
-109.06 |
8.6 |
-9.92 |
-0.42 |
0 |