List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
253700 |
103120080 |
2 |
ON2C5H6 |
AB2C5D6 |
-19.46 |
2.24 |
-9.56 |
-1.2 |
0 |
|
|
253701 |
103120088 |
1 |
O2N3C14H17 |
A2B3C14D17 |
-34.81 |
3.25 |
-8.84 |
-0.46 |
0 |
|
|
253702 |
103120089 |
1 |
O2N4C13H16 |
A2B4C13D16 |
-30.83 |
2.52 |
-9.63 |
-1.26 |
0 |
|
|
253703 |
103120096 |
1 |
O2N3C14H19 |
A2B3C14D19 |
-42.36 |
4.05 |
-8.91 |
-0.52 |
0 |
|
|
253704 |
103120102 |
1 |
O2N3C15H19 |
A2B3C15D19 |
-38.93 |
2.92 |
-8.91 |
-0.5 |
0 |
|
|
253705 |
103120110 |
1 |
SO2N5C13H19 |
AB2C5D13E19 |
-4.08 |
5.76 |
-9.04 |
-0.29 |
0 |
|
|
253706 |
103120114 |
1 |
O2N3C11H19 |
A2B3C11D19 |
-64.22 |
4.91 |
-9.37 |
0.38 |
0 |
|
|
253707 |
103120116 |
1 |
O2N3C14H19 |
A2B3C14D19 |
-41.72 |
1.67 |
-9.11 |
-0.8 |
0 |
|
|
253708 |
103120120 |
1 |
O2N3C15H21 |
A2B3C15D21 |
-55.33 |
6.95 |
-9.0 |
-0.63 |
0 |
|
|
253709 |
103120123 |
1 |
O2N3C14H19 |
A2B3C14D19 |
-36.44 |
4.25 |
-8.87 |
-0.52 |
0 |
|
|
253710 |
103120130 |
1 |
O2N4H14C15 |
A2B4C14D15 |
5.27 |
3.22 |
-8.86 |
-1.25 |
0 |
|
|
253711 |
103120133 |
1 |
O3N4C12H16 |
A3B4C12D16 |
-50.33 |
5.24 |
-9.45 |
-1.26 |
0 |
|
|
253712 |
103120154 |
1 |
O2N3C16H21 |
A2B3C16D21 |
-43.24 |
6.53 |
-8.89 |
-0.43 |
0 |
|
|
253713 |
103120156 |
1 |
N3O3C13H17 |
A3B3C13D17 |
-73.17 |
4.98 |
-8.95 |
-0.58 |
0 |
|
|
253714 |
103120159 |
1 |
O2N4C13H18 |
A2B4C13D18 |
-31.96 |
3.76 |
-9.47 |
-1.14 |
0 |
|
|
253715 |
103120160 |
1 |
O2N3C15H21 |
A2B3C15D21 |
-51.06 |
4.72 |
-8.81 |
-0.43 |
0 |
|
|
253716 |
103120174 |
2 |
ON2C6H7 |
AB2C6D7 |
1.49 |
3.1 |
-9.61 |
-1.25 |
0 |
|
|
253717 |
103120184 |
2 |
ON2H6C7 |
AB2C6D7 |
16.68 |
5.58 |
-8.98 |
-1.55 |
0 |
|
|
253718 |
103120186 |
1 |
O2N3H13C15 |
A2B3C13D15 |
-0.19 |
4.69 |
-8.75 |
-1.08 |
0 |
|
|
253719 |
103120201 |
1 |
O2N3C14H23 |
A2B3C14D23 |
-81.33 |
4.16 |
-9.38 |
0.21 |
0 |
|
|
253720 |
103120207 |
2 |
ON2C7H9 |
AB2C7D9 |
-25.64 |
3.87 |
-9.63 |
-1.28 |
0 |
|
|
253721 |
103120210 |
1 |
O2N4C15H20 |
A2B4C15D20 |
-34.53 |
3.09 |
-9.52 |
-1.17 |
0 |
|
|
253722 |
103120215 |
1 |
O2N3C12H13 |
A2B3C12D13 |
-13.17 |
1.87 |
-9.13 |
-0.81 |
0 |
|
|
253723 |
103120217 |
1 |
O2N3C10H15 |
A2B3C10D15 |
-38.13 |
5.08 |
-9.35 |
0.17 |
0 |
|
|
253724 |
103120221 |
1 |
O2N3C15H19 |
A2B3C15D19 |
-25.49 |
4.79 |
-8.81 |
-0.45 |
0 |
|
|
253725 |
103120228 |
1 |
O2N3C11H15 |
A2B3C11D15 |
-11.21 |
5.78 |
-9.5 |
0.01 |
0 |
|
|
253726 |
103120229 |
1 |
O2N3C15H17 |
A2B3C15D17 |
6.3 |
5.04 |
-8.92 |
-0.56 |
0 |
|
|
253727 |
103120246 |
1 |
O2N3C16H23 |
A2B3C16D23 |
-62.52 |
3.96 |
-8.81 |
-0.42 |
0 |
|
|
253728 |
103120247 |
1 |
O2N3C15H21 |
A2B3C15D21 |
-57.5 |
5.65 |
-9.17 |
-0.92 |
0 |
|
|
253729 |
103120254 |
1 |
N3O3C13H17 |
A3B3C13D17 |
-88.37 |
7.83 |
-9.09 |
-0.73 |
0 |
|
|
253730 |
103120263 |
1 |
O2N3C8H13 |
A2B3C8D13 |
-55.95 |
5.76 |
-9.61 |
0.0 |
0 |
|
|
253731 |
103120265 |
1 |
O2N5C10H13 |
A2B5C10D13 |
3.7 |
3.04 |
-9.15 |
-0.21 |
0 |
|
|
253732 |
103120266 |
1 |
O2N3C11H13 |
A2B3C11D13 |
-33.81 |
2.84 |
-9.28 |
-0.95 |
0 |
|
|
253733 |
103120268 |
1 |
O2N3C14H19 |
A2B3C14D19 |
-47.9 |
3.4 |
-8.87 |
-0.49 |
0 |
|
|
253734 |
103120274 |
2 |
ON2C6H8 |
AB2C6D8 |
-26.41 |
2.65 |
-9.32 |
-1.11 |
0 |
|
|
253735 |
103120279 |
1 |
N3O3C13H15 |
A3B3C13D15 |
-70.87 |
4.68 |
-8.92 |
-0.57 |
0 |
|
|
253736 |
103120304 |
1 |
O2N4C13H16 |
A2B4C13D16 |
-21.63 |
2.9 |
-9.42 |
-1.18 |
0 |
|
|
253737 |
103120316 |
1 |
O3N4C12H16 |
A3B4C12D16 |
-52.08 |
6.3 |
-9.57 |
-1.32 |
0 |
|
|
253738 |
103120317 |
1 |
N3O3C14H19 |
A3B3C14D19 |
-71.36 |
4.88 |
-8.99 |
-0.65 |
0 |
|
|
253739 |
103120318 |
2 |
ON2C6H8 |
AB2C6D8 |
-20.23 |
3.0 |
-9.63 |
-1.34 |
0 |
|
|
253740 |
103120319 |
1 |
O2N3C14H19 |
A2B3C14D19 |
-38.1 |
6.35 |
-8.9 |
-0.49 |
0 |
|
|
253741 |
103120326 |
1 |
O2N3C12H15 |
A2B3C12D15 |
-39.92 |
3.53 |
-9.27 |
-0.95 |
0 |
|
|
253742 |
103120348 |
1 |
O2N4C13H16 |
A2B4C13D16 |
-25.04 |
2.66 |
-9.39 |
-1.2 |
0 |
|
|
253743 |
103120354 |
2 |
ON2C7H9 |
AB2C7D9 |
-22.54 |
4.41 |
-9.46 |
-1.24 |
0 |
|
|
253744 |
103120358 |
1 |
FO2N5C12H16 |
AB2C5D12E16 |
-51.37 |
5.53 |
-9.63 |
-0.39 |
0 |
|
|
253745 |
103120364 |
1 |
O3N4C14H18 |
A3B4C14D18 |
-64.49 |
4.69 |
-9.38 |
-1.32 |
0 |
|
|
253746 |
103120373 |
1 |
O2N3C14H17 |
A2B3C14D17 |
-26.61 |
6.57 |
-9.48 |
0.01 |
0 |
|
|
253747 |
103120374 |
2 |
ON2C7H9 |
AB2C7D9 |
-19.7 |
1.11 |
-9.48 |
-1.33 |
0 |
|
|
253748 |
103120376 |
1 |
O2N3C15H19 |
A2B3C15D19 |
-38.61 |
2.83 |
-9.05 |
-0.78 |
0 |
|
|
253749 |
103120377 |
1 |
O2N3C15H19 |
A2B3C15D19 |
-46.26 |
4.58 |
-8.92 |
-0.55 |
0 |