List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
333131 |
127251679 |
1 |
O2N5C25H35 |
A2B5C25D35 |
-58.09 |
3.95 |
-8.55 |
-0.32 |
0 |
|
|
333132 |
127251680 |
1 |
FO2N5C25H28 |
AB2C5D25E28 |
-44.63 |
3.84 |
-8.85 |
-0.49 |
0 |
|
|
333133 |
127251681 |
1 |
O3N5C23H27 |
A3B5C23D27 |
-55.41 |
5.87 |
-8.7 |
-0.38 |
0 |
|
|
333134 |
127251682 |
1 |
O3N6C23H28 |
A3B6C23D28 |
-57.66 |
5.56 |
-8.95 |
-0.48 |
0 |
|
|
333135 |
127251683 |
1 |
SO3N6C19H22 |
AB3C6D19E22 |
-20.24 |
7.55 |
-9.23 |
-1.2 |
0 |
|
|
333136 |
127251684 |
2 |
ON3C12H12 |
AB3C12D12 |
31.88 |
6.3 |
-8.78 |
-0.44 |
0 |
|
|
333137 |
127251685 |
1 |
O2N6C25H26 |
A2B6C25D26 |
20.6 |
5.77 |
-8.71 |
-0.45 |
0 |
|
|
333138 |
127251686 |
1 |
O2N6C25H26 |
A2B6C25D26 |
23.77 |
6.15 |
-8.58 |
-0.39 |
0 |
|
|
333139 |
127251687 |
1 |
O3N5C20H29 |
A3B5C20D29 |
-69.96 |
6.02 |
-8.53 |
-0.83 |
0 |
|
|
333140 |
127251688 |
2 |
ON3C12H16 |
AB3C12D16 |
-14.59 |
8.88 |
-8.87 |
-1.04 |
0 |
|
|
333141 |
127251689 |
1 |
O3N6C24H26 |
A3B6C24D26 |
4.92 |
8.22 |
-8.87 |
-1.11 |
0 |
|
|
333142 |
127251690 |
1 |
O2N6C19H24 |
A2B6C19D24 |
5.32 |
5.93 |
-8.84 |
-1.17 |
0 |
|
|
333143 |
127251691 |
1 |
O3N5C21H25 |
A3B5C21D25 |
-51.0 |
5.29 |
-8.66 |
-1.22 |
0 |
|
|
333144 |
127251692 |
1 |
O3N6C22H26 |
A3B6C22D26 |
-13.22 |
7.06 |
-8.56 |
-0.85 |
0 |
|
|
333145 |
127251693 |
1 |
O3N5C24H35 |
A3B5C24D35 |
-77.99 |
4.13 |
-8.6 |
-0.92 |
0 |
|
|
333146 |
127251694 |
2 |
ON3C12H16 |
AB3C12D16 |
-13.13 |
8.19 |
-8.83 |
-1.12 |
0 |
|
|
333147 |
127251695 |
1 |
O3N6C20H26 |
A3B6C20D26 |
-36.29 |
9.19 |
-8.84 |
-1.01 |
0 |
|
|
333148 |
127251696 |
1 |
FO2N6C24H25 |
AB2C6D24E25 |
-14.79 |
8.89 |
-8.87 |
-1.08 |
0 |
|
|
333149 |
127251697 |
1 |
O3N5C22H31 |
A3B5C22D31 |
-69.44 |
5.91 |
-8.54 |
-0.82 |
0 |
|
|
333150 |
127251698 |
1 |
O3N5C23H33 |
A3B5C23D33 |
-85.98 |
6.15 |
-8.73 |
-0.81 |
0 |
|
|
333151 |
127251699 |
1 |
O3N5C24H35 |
A3B5C24D35 |
-91.6 |
5.9 |
-8.71 |
-0.8 |
0 |
|
|
333152 |
127251700 |
1 |
O2N6C23H30 |
A2B6C23D30 |
-7.84 |
9.0 |
-8.85 |
-1.04 |
0 |
|
|
333153 |
127251701 |
1 |
O3N6C24H28 |
A3B6C24D28 |
12.69 |
4.34 |
-8.55 |
-0.89 |
0 |
|
|
333154 |
127251702 |
1 |
O3N4C20H22 |
A3B4C20D22 |
-66.04 |
4.77 |
-9.23 |
-0.93 |
0 |
|
|
333155 |
127251703 |
1 |
FO3N4C20H21 |
AB3C4D20E21 |
-114.13 |
5.6 |
-9.35 |
-0.97 |
0 |
|
|
333156 |
127251704 |
2 |
N2O2C10H13 |
A2B2C10D13 |
-157.59 |
4.98 |
-9.45 |
-1.08 |
0 |
|
|
333157 |
127251705 |
1 |
O4N5C20H21 |
A4B5C20D21 |
-107.53 |
5.44 |
-9.49 |
-1.06 |
0 |
|
|
333158 |
127251706 |
1 |
N4O4C19H24 |
A4B4C19D24 |
-151.02 |
5.3 |
-9.48 |
-1.06 |
0 |
|
|
333159 |
127251707 |
2 |
N2O2C10H13 |
A2B2C10D13 |
-156.65 |
5.31 |
-9.49 |
-1.06 |
0 |
|
|
333160 |
127251708 |
1 |
O4N5C22H25 |
A4B5C22D25 |
-120.05 |
5.92 |
-8.85 |
-1.08 |
0 |
|
|
333161 |
127251709 |
1 |
O3N5C23H23 |
A3B5C23D23 |
-38.34 |
4.01 |
-9.26 |
-1.08 |
0 |
|
|
333162 |
127251710 |
1 |
SO4N5C19H21 |
AB4C5D19E21 |
-112.07 |
2.2 |
-9.5 |
-1.14 |
0 |
|
|
333163 |
127251711 |
1 |
O4N5H19C20 |
A4B5C19D20 |
-57.04 |
2.24 |
-8.69 |
-1.0 |
0 |
|
|
333164 |
127251712 |
1 |
FSO3N5C18H18 |
ABC3D5E18F18 |
-76.65 |
3.82 |
-9.44 |
-1.06 |
0 |
|
|
333165 |
127251713 |
2 |
ON3C12H14 |
AB3C12D14 |
6.77 |
5.7 |
-8.88 |
-1.13 |
0 |
|
|
333166 |
127251714 |
1 |
O2N6C25H30 |
A2B6C25D30 |
-7.09 |
3.59 |
-8.76 |
-0.96 |
0 |
|
|
333167 |
127251715 |
1 |
ClO2N6C22H23 |
AB2C6D22E23 |
20.14 |
4.14 |
-9.03 |
-1.02 |
0 |
|
|
333168 |
127251716 |
1 |
O3N6C24H26 |
A3B6C24D26 |
-28.57 |
7.68 |
-8.23 |
-0.88 |
0 |
|
|
333169 |
127251717 |
1 |
O3N5C25H29 |
A3B5C25D29 |
-55.83 |
7.86 |
-8.28 |
-0.82 |
0 |
|
|
333170 |
127251718 |
1 |
O3N5C23H25 |
A3B5C23D25 |
-34.52 |
7.66 |
-9.42 |
-1.2 |
0 |
|
|
333171 |
127251719 |
2 |
ON3C11H11 |
AB3C11D11 |
21.1 |
2.32 |
-8.28 |
-1.01 |
0 |
|
|
333172 |
127251720 |
1 |
FO3N5C20H20 |
AB3C5D20E20 |
-79.3 |
6.28 |
-9.01 |
-1.11 |
0 |
|
|
333173 |
127251721 |
1 |
O2N6C21H30 |
A2B6C21D30 |
-31.08 |
8.16 |
-8.64 |
-0.97 |
0 |
|
|
333174 |
127251722 |
1 |
ClO2N5C21H22 |
AB2C5D21E22 |
-18.14 |
4.5 |
-9.18 |
-0.96 |
0 |
|
|
333175 |
127251723 |
1 |
O3N5C21H23 |
A3B5C21D23 |
-39.53 |
6.46 |
-9.32 |
-0.92 |
0 |
|
|
333176 |
127251724 |
1 |
FSO3N5C18H18 |
ABC3D5E18F18 |
-75.28 |
6.86 |
-9.42 |
-1.0 |
0 |
|
|
333177 |
127251725 |
1 |
O3N6C22H26 |
A3B6C22D26 |
-26.33 |
8.32 |
-7.94 |
-1.07 |
0 |
|
|
333178 |
127251726 |
1 |
O2N4C23H26 |
A2B4C23D26 |
3.29 |
3.79 |
-8.85 |
0.1 |
0 |
|
|
333179 |
127251727 |
2 |
ON2C9H12 |
AB2C9D12 |
-29.02 |
4.65 |
-8.74 |
0.28 |
0 |
|
|
333180 |
127251728 |
2 |
ON2C10H14 |
AB2C10D14 |
-40.4 |
5.97 |
-8.74 |
0.27 |
0 |