List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
280525 |
103849752 |
1 |
FSO4C14H19 |
ABC4D14E19 |
-212.32 |
5.74 |
-9.73 |
-0.72 |
0 |
|
|
280526 |
103849754 |
1 |
FSO4C14H19 |
ABC4D14E19 |
-211.35 |
6.42 |
-9.65 |
-0.65 |
0 |
|
|
280527 |
103849755 |
1 |
FSO4C11H13 |
ABC4D11E13 |
-195.21 |
5.96 |
-9.63 |
-0.59 |
0 |
|
|
280528 |
103849758 |
1 |
FO3C12H15 |
AB3C12D15 |
-171.34 |
3.55 |
-9.57 |
-0.53 |
0 |
|
|
280529 |
103849761 |
1 |
FSO4C14H19 |
ABC4D14E19 |
-204.34 |
5.7 |
-9.48 |
-0.77 |
0 |
|
|
280530 |
103849762 |
1 |
FNO3C13H16 |
ABC3D13E16 |
-137.59 |
5.56 |
-9.78 |
-0.86 |
0 |
|
|
280531 |
103849764 |
1 |
F2O2H14C15 |
A2B2C14D15 |
-139.78 |
2.88 |
-8.89 |
-0.46 |
0 |
|
|
280532 |
103849768 |
1 |
SO4C16H22 |
AB4C16D22 |
-165.72 |
7.39 |
-9.0 |
-0.56 |
0 |
|
|
280533 |
103849770 |
1 |
F2O2H14C15 |
A2B2C14D15 |
-138.39 |
3.26 |
-8.88 |
-0.46 |
0 |
|
|
280534 |
103849778 |
1 |
FNSO3C13H16 |
ABCD3E13F16 |
-135.2 |
3.68 |
-9.8 |
-0.91 |
0 |
|
|
280535 |
103849785 |
1 |
FNO2C11H12 |
ABC2D11E12 |
-90.05 |
4.71 |
-9.53 |
-0.87 |
0 |
|
|
280536 |
103849788 |
1 |
NO4C12H15 |
AB4C12D15 |
-158.32 |
3.94 |
-9.57 |
-0.56 |
0 |
|
|
280537 |
103849789 |
1 |
N3O4C12H23 |
A3B4C12D23 |
-205.61 |
4.88 |
-9.91 |
0.44 |
0 |
|
|
280538 |
103849802 |
1 |
FNO4C12H14 |
ABC4D12E14 |
-212.61 |
4.7 |
-9.61 |
-0.83 |
0 |
|
|
280539 |
103849808 |
1 |
NSO5C9H17 |
ABC5D9E17 |
-232.47 |
10.33 |
-9.61 |
0.11 |
0 |
|
|
280540 |
103849810 |
1 |
ClNO4C12H14 |
ABC4D12E14 |
-166.73 |
2.9 |
-9.56 |
-0.7 |
0 |
|
|
280541 |
103849812 |
1 |
BrN2O5C12H15 |
AB2C5D12E15 |
-177.71 |
3.28 |
-9.87 |
-1.09 |
0 |
|
|
280542 |
103849816 |
1 |
NO5C13H17 |
AB5C13D17 |
-200.13 |
4.29 |
-8.61 |
-0.81 |
0 |
|
|
280543 |
103849818 |
1 |
Br2N2O3C14H14 |
A2B2C3D14E14 |
-90.51 |
6.78 |
-9.26 |
-0.95 |
0 |
|
|
280544 |
103849825 |
1 |
NO4C13H17 |
AB4C13D17 |
-167.5 |
2.25 |
-9.25 |
-0.05 |
0 |
|
|
280545 |
103849830 |
1 |
BrSO4C12H15 |
ABC4D12E15 |
-147.1 |
9.38 |
-9.46 |
-0.66 |
0 |
|
|
280546 |
103849834 |
1 |
ClNSO5C12H16 |
ABCD5E12F16 |
-133.0 |
10.56 |
-10.01 |
-1.32 |
0 |
|
|
280547 |
103849838 |
1 |
NO2C15H19 |
AB2C15D19 |
-62.88 |
4.09 |
-9.26 |
-0.66 |
0 |
|
|
280548 |
103849847 |
1 |
ClNSO3C13H16 |
ABCD3E13F16 |
-96.51 |
2.36 |
-9.81 |
-1.07 |
0 |
|
|
280549 |
103849855 |
1 |
BrClOSN3H5C9 |
ABCDE3F5G9 |
37.07 |
6.93 |
-9.26 |
-1.53 |
0 |
|
|
280550 |
103849856 |
1 |
BrOCl3N3H5C11 |
ABC3D3E5F11 |
19.65 |
4.5 |
-9.48 |
-1.78 |
0 |
|
|
280551 |
103849865 |
1 |
FNO4H8C15 |
ABC4D8E15 |
-43.51 |
3.92 |
-9.99 |
-2.07 |
0 |
|
|
280552 |
103849871 |
1 |
F3N4H11C13 |
A3B4C11D13 |
-81.64 |
7.02 |
-8.97 |
-0.91 |
0 |
|
|
280553 |
103849874 |
2 |
ON3C6H7 |
AB3C6D7 |
-24.97 |
6.65 |
-8.94 |
-0.81 |
0 |
|
|
280554 |
103849883 |
1 |
OSN2C13H18 |
ABC2D13E18 |
-25.89 |
3.07 |
-8.9 |
0.13 |
0 |
|
|
280555 |
103849889 |
1 |
ON2C13H28 |
AB2C13D28 |
-71.42 |
2.64 |
-8.19 |
1.92 |
0 |
|
|
280556 |
103849892 |
1 |
FS2N3O4H8C10 |
AB2C3D4E8F10 |
-116.81 |
7.4 |
-9.28 |
-1.76 |
0 |
|
|
280557 |
103849895 |
1 |
SO2N3C11H11 |
AB2C3D11E11 |
-2.51 |
1.12 |
-10.56 |
-1.55 |
0 |
|
|
280558 |
103849896 |
1 |
O2S2N3C7H9 |
A2B2C3D7E9 |
-19.3 |
4.97 |
-10.08 |
-1.46 |
0 |
|
|
280559 |
103849901 |
1 |
O2S2N3C9H11 |
A2B2C3D9E11 |
-0.68 |
2.86 |
-10.05 |
-1.44 |
0 |
|
|
280560 |
103849902 |
1 |
NO6C12H19 |
AB6C12D19 |
-273.42 |
3.18 |
-10.02 |
0.08 |
0 |
|
|
280561 |
103849903 |
1 |
O2S2N3C12H17 |
A2B2C3D12E17 |
-36.23 |
8.58 |
-10.07 |
-1.44 |
0 |
|
|
280562 |
103849904 |
1 |
O2N3C14H17 |
A2B3C14D17 |
-54.17 |
4.89 |
-8.87 |
-0.09 |
0 |
|
|
280563 |
103849908 |
1 |
NO4C11H19 |
AB4C11D19 |
-197.48 |
1.31 |
-9.87 |
0.52 |
0 |
|
|
280564 |
103849909 |
1 |
NO4C11H19 |
AB4C11D19 |
-200.98 |
1.84 |
-9.77 |
0.73 |
0 |
|
|
280565 |
103849910 |
1 |
NO4C9H15 |
AB4C9D15 |
-177.77 |
2.93 |
-9.53 |
0.34 |
0 |
|
|
280566 |
103849912 |
1 |
NO4C19H21 |
AB4C19D21 |
-149.44 |
5.32 |
-9.45 |
-0.48 |
0 |
|
|
280567 |
103849913 |
1 |
NO4H25C26 |
AB4C25D26 |
-120.13 |
6.02 |
-8.93 |
-0.49 |
0 |
|
|
280568 |
103849919 |
1 |
NO4C28H29 |
AB4C28D29 |
-122.25 |
3.93 |
-8.79 |
-0.34 |
0 |
|
|
280569 |
103849920 |
1 |
NO3C19H27 |
AB3C19D27 |
-155.52 |
3.48 |
-9.41 |
-0.38 |
0 |
|
|
280570 |
103849921 |
1 |
BrNO2C13H16 |
ABC2D13E16 |
-76.39 |
1.27 |
-9.68 |
-0.25 |
0 |
|
|
280571 |
103849929 |
1 |
NO2C10H19 |
AB2C10D19 |
-101.63 |
2.16 |
-9.44 |
0.95 |
0 |
|
|
280572 |
103849933 |
1 |
O2N3C12H15 |
A2B3C12D15 |
-30.8 |
2.32 |
-9.22 |
-0.92 |
0 |
|
|
280573 |
103849938 |
1 |
BrClNO2C11H13 |
ABCD2E11F13 |
-73.72 |
4.27 |
-9.69 |
-0.9 |
0 |
|
|
280574 |
103849946 |
1 |
NO3C10H17 |
AB3C10D17 |
-147.73 |
1.76 |
-9.33 |
0.88 |
0 |
|
|
280575 |
103849952 |
1 |
O2N3C8H11 |
A2B3C8D11 |
-47.45 |
2.87 |
-8.79 |
0.37 |
0 |
|
|
280576 |
103849959 |
1 |
BrNO2C12H14 |
ABC2D12E14 |
-74.56 |
5.49 |
-8.9 |
-0.21 |
0 |
|
|
280577 |
103849970 |
1 |
BrNSO2C11H14 |
ABCD2E11F14 |
-52.67 |
2.56 |
-9.24 |
-0.59 |
0 |
|
|
280578 |
103849981 |
1 |
FCl2O2H7C10 |
AB2C2D7E10 |
-83.71 |
2.34 |
-9.74 |
-1.09 |
0 |
|
|
280579 |
103849983 |
1 |
FNO4C14H18 |
ABC4D14E18 |
-182.07 |
6.21 |
-9.6 |
-1.02 |
0 |
|
|
280580 |
103849993 |
1 |
FO3C12H15 |
AB3C12D15 |
-140.77 |
3.86 |
-9.39 |
-0.82 |
0 |
|
|
280581 |
103849997 |
1 |
ClFNO3H11C15 |
ABCD3E11F15 |
-107.39 |
3.56 |
-9.25 |
-1.19 |
0 |
|
|
280582 |
103850005 |
1 |
FNO3H12C13 |
ABC3D12E13 |
-91.37 |
3.64 |
-9.64 |
-1.04 |
0 |
|
|
280583 |
103850007 |
1 |
FNO3H14C16 |
ABC3D14E16 |
-107.01 |
1.06 |
-8.96 |
-1.19 |
0 |
|
|
280584 |
103850024 |
1 |
O2F4H10C15 |
A2B4C10D15 |
-222.76 |
1.02 |
-9.66 |
-1.04 |
0 |
|
|
280585 |
103850025 |
1 |
FNO3H8C11 |
ABC3D8E11 |
-57.5 |
3.67 |
-9.69 |
-1.06 |
0 |
|
|
280586 |
103850027 |
1 |
FNSO2H12C13 |
ABCD2E12F13 |
-60.38 |
5.0 |
-9.44 |
-0.88 |
0 |
|
|
280587 |
103850040 |
1 |
FNO3C13H14 |
ABC3D13E14 |
-118.71 |
2.68 |
-9.7 |
-1.06 |
0 |
|
|
280588 |
103850042 |
1 |
BrFNO3H11C15 |
ABCD3E11F15 |
-97.16 |
1.86 |
-9.38 |
-1.25 |
0 |
|
|
280589 |
103850045 |
1 |
FNO3C14H18 |
ABC3D14E18 |
-150.49 |
1.65 |
-9.72 |
-1.09 |
0 |
|
|
280590 |
103850046 |
1 |
FO2C13H15 |
AB2C13D15 |
-104.22 |
4.33 |
-9.32 |
-0.77 |
0 |
|
|
280591 |
103850048 |
1 |
FN2O2C16H17 |
AB2C2D16E17 |
-54.32 |
6.68 |
-9.28 |
-0.74 |
0 |
|
|
280592 |
103850054 |
1 |
FNO3H12C13 |
ABC3D12E13 |
-82.36 |
2.07 |
-9.43 |
-0.88 |
0 |
|
|
280593 |
103850055 |
1 |
FNO3C12H14 |
ABC3D12E14 |
-141.57 |
4.77 |
-9.78 |
-1.1 |
0 |
|
|
280594 |
103850057 |
1 |
FNO3C15H18 |
ABC3D15E18 |
-134.54 |
4.84 |
-9.41 |
-0.84 |
0 |
|
|
280595 |
103850063 |
1 |
FO3C12H15 |
AB3C12D15 |
-144.87 |
4.69 |
-9.3 |
-0.77 |
0 |
|
|
280596 |
103850099 |
2 |
FOC5H5 |
ABC5D5 |
-145.41 |
3.26 |
-9.42 |
-0.86 |
0 |
|
|
280597 |
103850111 |
1 |
ClFNO3H11C15 |
ABCD3E11F15 |
-108.5 |
3.53 |
-9.1 |
-1.34 |
0 |
|
|
280598 |
103850113 |
1 |
FNO3C14H18 |
ABC3D14E18 |
-151.59 |
3.35 |
-9.71 |
-1.07 |
0 |
|
|
280599 |
103850114 |
1 |
FNO3C10H10 |
ABC3D10E10 |
-126.24 |
1.22 |
-9.8 |
-1.17 |
0 |