List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
337694 |
127258317 |
1 |
NBr2O3C13H13 |
AB2C3D13E13 |
-96.15 |
8.01 |
-8.9 |
-0.91 |
0 |
|
|
337695 |
127258318 |
1 |
NCl2O3C13H13 |
AB2C3D13E13 |
-115.9 |
8.05 |
-8.82 |
-0.91 |
0 |
|
|
337696 |
127258319 |
1 |
ClN3O3C10H10 |
AB3C3D10E10 |
-16.76 |
5.07 |
-8.8 |
-1.45 |
0 |
|
|
337697 |
127258320 |
1 |
ClNO3C13H14 |
ABC3D13E14 |
-105.96 |
7.36 |
-8.64 |
-0.77 |
0 |
|
|
337698 |
127258321 |
1 |
O2N3C18H19 |
A2B3C18D19 |
-19.77 |
4.74 |
-8.67 |
-1.01 |
0 |
|
|
337699 |
127258322 |
1 |
O2N3C17H17 |
A2B3C17D17 |
-11.0 |
4.38 |
-8.73 |
-1.08 |
0 |
|
|
337700 |
127258323 |
1 |
NCl2O3C13H13 |
AB2C3D13E13 |
-114.65 |
9.75 |
-8.72 |
-0.96 |
0 |
|
|
337701 |
127258324 |
1 |
NCl2O3C13H13 |
AB2C3D13E13 |
-118.57 |
9.73 |
-9.06 |
-0.99 |
0 |
|
|
337702 |
127258325 |
1 |
BrNO3C13H14 |
ABC3D13E14 |
-96.4 |
8.12 |
-8.81 |
-0.87 |
0 |
|
|
337703 |
127258326 |
1 |
ClN3O3C11H12 |
AB3C3D11E12 |
-25.46 |
5.04 |
-9.15 |
-1.49 |
0 |
|
|
337704 |
127258327 |
1 |
ClNO3C14H16 |
ABC3D14E16 |
-113.17 |
7.73 |
-8.99 |
-0.74 |
0 |
|
|
337705 |
127258328 |
1 |
ClNO3C14H16 |
ABC3D14E16 |
-117.52 |
7.09 |
-8.52 |
-0.78 |
0 |
|
|
337706 |
127258329 |
1 |
ClNO3C13H14 |
ABC3D13E14 |
-108.66 |
8.08 |
-8.8 |
-0.86 |
0 |
|
|
337707 |
127258330 |
1 |
N2O3C14H14 |
A2B3C14D14 |
-66.86 |
11.21 |
-8.99 |
-0.96 |
0 |
|
|
337708 |
127258331 |
1 |
BrNO3C14H16 |
ABC3D14E16 |
-107.0 |
9.02 |
-8.6 |
-0.84 |
0 |
|
|
337709 |
127258332 |
1 |
BrNO3C13H14 |
ABC3D13E14 |
-96.62 |
9.31 |
-8.66 |
-0.88 |
0 |
|
|
337710 |
127258333 |
1 |
ClNO3C14H16 |
ABC3D14E16 |
-116.44 |
9.03 |
-8.47 |
-0.8 |
0 |
|
|
337711 |
127258334 |
1 |
N3O3C17H17 |
A3B3C17D17 |
-44.89 |
2.81 |
-8.25 |
-1.14 |
0 |
|
|
337712 |
127258335 |
2 |
NO2H8C9 |
AB2C8D9 |
-31.63 |
4.81 |
-8.94 |
-1.52 |
0 |
|
|
337713 |
127258336 |
1 |
BrNO3C14H16 |
ABC3D14E16 |
-104.43 |
8.06 |
-8.62 |
-0.82 |
0 |
|
|
337714 |
127258337 |
1 |
ClNO3C14H16 |
ABC3D14E16 |
-116.48 |
8.08 |
-8.58 |
-0.82 |
0 |
|
|
337715 |
127258338 |
1 |
N4O5C7H10 |
A4B5C7D10 |
-162.99 |
5.54 |
-10.66 |
-1.44 |
0 |
|
|
337716 |
127258339 |
1 |
N4O4C7H8 |
A4B4C7D8 |
-84.76 |
1.46 |
-10.75 |
-1.15 |
0 |
|
|
337717 |
127258340 |
1 |
NO2C20H23 |
AB2C20D23 |
-36.2 |
5.55 |
-8.45 |
-0.02 |
0 |
|
|
337718 |
127258341 |
1 |
N4O4C11H16 |
A4B4C11D16 |
-102.18 |
1.89 |
-10.14 |
-1.15 |
0 |
|
|
337719 |
127258342 |
1 |
NO3C19H19 |
AB3C19D19 |
-73.15 |
6.88 |
-8.52 |
-0.63 |
0 |
|
|
337720 |
127258343 |
1 |
ClON3C16H20 |
ABC3D16E20 |
-5.01 |
5.89 |
-8.59 |
-0.02 |
0 |
|
|
337721 |
127258344 |
1 |
ClNO4H18C19 |
ABC4D18E19 |
-115.51 |
10.01 |
-8.5 |
-0.87 |
0 |
|
|
337722 |
127258345 |
1 |
NO5C14H15 |
AB5C14D15 |
-161.73 |
7.48 |
-8.18 |
-0.79 |
0 |
|
|
337723 |
127258346 |
1 |
O7C20H32 |
A7B20C32 |
-348.75 |
5.34 |
-9.71 |
-0.92 |
0 |
|
|
337724 |
127258347 |
1 |
O9C20H28 |
A9B20C28 |
-398.86 |
9.03 |
-10.64 |
-1.61 |
0 |
|
|
337725 |
127258348 |
1 |
O5C6H10 |
A5B6C10 |
-214.3 |
2.68 |
-10.84 |
-1.1 |
0 |
|
|
337726 |
127258349 |
2 |
NO2C10H12 |
AB2C10D12 |
-134.86 |
0.69 |
-9.36 |
0.1 |
0 |
|
|
337727 |
127258350 |
2 |
NO2C8H8 |
AB2C8D8 |
-116.55 |
4.2 |
-8.99 |
-0.51 |
0 |
|
|
337728 |
127258351 |
1 |
N2O2C21H26 |
A2B2C21D26 |
-54.09 |
4.97 |
-9.26 |
0.06 |
0 |
|
|
337729 |
127258352 |
1 |
N2O3C20H40 |
A2B3C20D40 |
-219.96 |
4.46 |
-9.74 |
0.73 |
0 |
|
|
337730 |
127258353 |
2 |
ON2C4H9 |
AB2C4D9 |
-99.09 |
7.0 |
-9.51 |
0.84 |
0 |
|
|
337731 |
127258354 |
2 |
ON2C8H17 |
AB2C8D17 |
-139.39 |
2.71 |
-9.32 |
0.97 |
0 |
|
|
337732 |
127258355 |
2 |
ON3C8H16 |
AB3C8D16 |
-91.8 |
2.18 |
-8.32 |
0.96 |
0 |
|
|
337733 |
127258356 |
2 |
ON2C5H11 |
AB2C5D11 |
-93.5 |
5.54 |
-8.94 |
0.85 |
0 |
|
|
337734 |
127258357 |
2 |
NO3C6H12 |
AB3C6D12 |
-283.48 |
1.45 |
-9.51 |
0.63 |
0 |
|
|
337735 |
127258358 |
2 |
ON2C9H19 |
AB2C9D19 |
-137.68 |
0.61 |
-8.5 |
1.06 |
0 |
|
|
337736 |
127258359 |
2 |
NSO3C10H10 |
ABC3D10E10 |
-157.88 |
7.53 |
-9.41 |
-0.93 |
0 |
|
|
337737 |
127258360 |
2 |
ON2C13H27 |
AB2C13D27 |
-180.67 |
2.3 |
-8.96 |
1.03 |
0 |
|
|
337738 |
127258361 |
1 |
N3O3C30H59 |
A3B3C30D59 |
-260.4 |
4.63 |
-9.75 |
0.48 |
0 |
|
|
337739 |
127258362 |
2 |
ClNOC2H3 |
ABCD2E3 |
-56.82 |
2.91 |
-10.04 |
-1.9 |
0 |
|
|
337740 |
127258363 |
2 |
NO2C8H8 |
AB2C8D8 |
-61.98 |
4.51 |
-8.99 |
-0.74 |
0 |
|
|
337741 |
127258364 |
1 |
N3O4C60H119 |
A3B4C60D119 |
-437.94 |
6.43 |
-9.64 |
0.18 |
0 |
|
|
337742 |
127258365 |
1 |
N3O3C11H21 |
A3B3C11D21 |
-154.23 |
3.66 |
-9.23 |
0.89 |
0 |
|
|
337743 |
127258366 |
1 |
SiN2O2Cl3C43H85 |
AB2C2D3E43F85 |
-403.47 |
1.85 |
-9.64 |
-0.76 |
0 |