List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
198795 |
79152627 |
1 |
ON3C11H23 |
AB3C11D23 |
-61.92 |
4.81 |
-8.99 |
1.15 |
0 |
|
|
198796 |
79152695 |
1 |
SO2N4C11H14 |
AB2C4D11E14 |
-13.18 |
4.87 |
-8.87 |
-0.7 |
0 |
|
|
198797 |
79152702 |
2 |
ON2C5H10 |
AB2C5D10 |
-75.36 |
5.66 |
-9.41 |
0.6 |
0 |
|
|
198798 |
79153050 |
1 |
O2N3C15H23 |
A2B3C15D23 |
-77.76 |
2.84 |
-8.07 |
0.11 |
0 |
|
|
198799 |
79153085 |
1 |
SN2O2C11H14 |
AB2C2D11E14 |
-9.96 |
4.66 |
-9.23 |
-0.81 |
0 |
|
|
198800 |
79153536 |
1 |
O2N4C7H16 |
A2B4C7D16 |
-46.87 |
3.61 |
-8.96 |
0.82 |
0 |
|
|
198801 |
79153537 |
1 |
O3N4C11H16 |
A3B4C11D16 |
-54.91 |
5.19 |
-8.45 |
-0.05 |
0 |
|
|
198802 |
79153538 |
1 |
O2N4C11H16 |
A2B4C11D16 |
-24.19 |
5.03 |
-8.88 |
-0.12 |
0 |
|
|
198803 |
79153921 |
1 |
N2S2O3C12H12 |
A2B2C3D12E12 |
-58.62 |
6.57 |
-8.95 |
-1.37 |
0 |
|
|
198804 |
79153938 |
1 |
ON3C13H19 |
AB3C13D19 |
-0.75 |
3.81 |
-8.39 |
0.22 |
0 |
|
|
198805 |
79154396 |
1 |
ON3C7H17 |
AB3C7D17 |
-63.17 |
3.51 |
-9.14 |
1.44 |
0 |
|
|
198806 |
79154397 |
1 |
ON3C11H17 |
AB3C11D17 |
-24.34 |
4.63 |
-9.1 |
-0.09 |
0 |
|
|
198807 |
79154398 |
1 |
ON3C11H25 |
AB3C11D25 |
-68.93 |
2.26 |
-9.04 |
1.16 |
0 |
|
|
198808 |
79154529 |
1 |
ON3C9H19 |
AB3C9D19 |
-56.19 |
2.71 |
-9.25 |
1.16 |
0 |
|
|
198809 |
79154769 |
1 |
O2N3C7H17 |
A2B3C7D17 |
-88.99 |
4.56 |
-9.41 |
1.04 |
0 |
|
|
198810 |
79154770 |
1 |
ON4C12H18 |
AB4C12D18 |
-0.92 |
3.09 |
-9.22 |
0.11 |
0 |
|
|
198811 |
79155003 |
1 |
ON3C12H23 |
AB3C12D23 |
-74.01 |
2.37 |
-9.22 |
1.31 |
0 |
|
|
198812 |
79155037 |
1 |
ON3C13H25 |
AB3C13D25 |
-71.53 |
4.52 |
-9.09 |
1.21 |
0 |
|
|
198813 |
79155038 |
1 |
ON3C13H25 |
AB3C13D25 |
-79.84 |
5.21 |
-9.18 |
1.23 |
0 |
|
|
198814 |
79155051 |
1 |
O2N4C13H26 |
A2B4C13D26 |
-90.04 |
2.13 |
-8.54 |
0.72 |
0 |
|
|
198815 |
79155052 |
1 |
O2N3C14H21 |
A2B3C14D21 |
-59.23 |
5.91 |
-8.91 |
-0.04 |
0 |
|
|
198816 |
79155053 |
2 |
ON2C7H14 |
AB2C7D14 |
-94.41 |
0.98 |
-9.03 |
0.72 |
0 |
|
|
198817 |
79155054 |
1 |
O2N3C10H21 |
A2B3C10D21 |
-104.32 |
2.04 |
-9.34 |
0.94 |
0 |
|
|
198818 |
79155055 |
1 |
O2N3C13H25 |
A2B3C13D25 |
-102.63 |
2.19 |
-9.05 |
0.96 |
0 |
|
|
198819 |
79155486 |
1 |
SO2N4C12H14 |
AB2C4D12E14 |
-29.94 |
4.13 |
-8.37 |
-0.57 |
0 |
|
|
198820 |
79155640 |
1 |
ON3C13H25 |
AB3C13D25 |
-83.57 |
3.17 |
-9.18 |
1.44 |
0 |
|
|
198821 |
79155641 |
1 |
ON3C14H19 |
AB3C14D19 |
-31.92 |
3.79 |
-7.91 |
0.33 |
0 |
|
|
198822 |
79156340 |
1 |
ClF2N2O2H13C14 |
AB2C2D2E13F14 |
-150.98 |
5.71 |
-9.12 |
-0.68 |
0 |
|
|
198823 |
79156551 |
1 |
O2N3C16H19 |
A2B3C16D19 |
-46.71 |
3.75 |
-8.98 |
-0.42 |
0 |
|
|
198824 |
79156552 |
1 |
N3O3C15H17 |
A3B3C15D17 |
-2.37 |
6.83 |
-9.69 |
-1.32 |
0 |
|
|
198825 |
79156662 |
1 |
NO4C15H15 |
AB4C15D15 |
-107.07 |
6.25 |
-9.01 |
-1.12 |
0 |
|
|
198826 |
79157496 |
1 |
ON4C16H28 |
AB4C16D28 |
-36.91 |
2.44 |
-9.19 |
0.86 |
0 |
|
|
198827 |
79157634 |
1 |
NO2C13H19 |
AB2C13D19 |
-83.43 |
4.68 |
-8.81 |
-0.18 |
0 |
|
|
198828 |
79158123 |
1 |
N2O2C17H30 |
A2B2C17D30 |
-97.67 |
5.16 |
-8.5 |
0.04 |
0 |
|
|
198829 |
79158124 |
1 |
ON3C16H25 |
AB3C16D25 |
-18.78 |
3.19 |
-8.86 |
-0.2 |
0 |
|
|
198830 |
79158125 |
1 |
O2N3C14H23 |
A2B3C14D23 |
-74.93 |
2.28 |
-9.04 |
-0.4 |
0 |
|
|
198831 |
79159111 |
1 |
ClN2O2C13H19 |
AB2C2D13E19 |
-50.61 |
2.49 |
-8.93 |
-0.13 |
0 |
|
|
198832 |
79159114 |
1 |
SN2O4C14H24 |
AB2C4D14E24 |
-150.56 |
5.58 |
-8.88 |
-0.15 |
0 |
|
|
198833 |
79159421 |
1 |
ON3C16H25 |
AB3C16D25 |
-48.08 |
2.95 |
-9.24 |
0.18 |
0 |
|
|
198834 |
79159814 |
1 |
ON4C15H30 |
AB4C15D30 |
-62.13 |
3.72 |
-8.65 |
1.14 |
0 |
|
|
198835 |
79159899 |
1 |
N3O3C14H21 |
A3B3C14D21 |
-109.71 |
3.45 |
-9.42 |
-0.16 |
0 |
|
|
198836 |
79159900 |
2 |
NO2C3H6 |
AB2C3D6 |
-139.93 |
4.04 |
-9.92 |
-0.05 |
0 |
|
|
198837 |
79159901 |
1 |
N3O3C13H17 |
A3B3C13D17 |
-108.94 |
3.96 |
-9.44 |
-1.0 |
0 |
|
|
198838 |
79160127 |
1 |
ON3C16H27 |
AB3C16D27 |
-62.01 |
6.24 |
-9.48 |
0.84 |
0 |
|
|
198839 |
79160400 |
1 |
ON3C14H29 |
AB3C14D29 |
-78.95 |
1.95 |
-8.67 |
1.21 |
0 |
|
|
198840 |
79160445 |
2 |
NOC7H10 |
ABC7D10 |
-87.15 |
3.28 |
-8.78 |
0.12 |
0 |
|
|
198841 |
79160635 |
1 |
N2O2C11H16 |
A2B2C11D16 |
-82.45 |
4.41 |
-8.47 |
0.24 |
0 |
|
|
198842 |
79160656 |
1 |
O2N3C13H23 |
A2B3C13D23 |
-109.38 |
1.61 |
-9.29 |
0.73 |
0 |
|
|
198843 |
79160745 |
1 |
BrN2O3C14H17 |
AB2C3D14E17 |
-120.32 |
5.66 |
-9.22 |
-0.75 |
0 |
|
|
198844 |
79160746 |
1 |
FN2O2C14H15 |
AB2C2D14E15 |
-73.3 |
5.44 |
-8.86 |
-0.59 |
0 |