List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
19633 |
569433 |
1 |
OCl2F3H7C14 |
AB2C3D7E14 |
-157.74 |
3.47 |
-10.16 |
-1.57 |
0 |
|
|
19634 |
569436 |
1 |
O3N5H11C13 |
A3B5C11D13 |
87.51 |
3.41 |
-9.26 |
-1.89 |
0 |
|
|
19635 |
569456 |
1 |
O3N4H10C11 |
A3B4C10D11 |
-24.31 |
3.39 |
-9.0 |
-1.3 |
0 |
|
|
19636 |
569463 |
1 |
OSN6H16C19 |
ABC6D16E19 |
126.04 |
11.18 |
-8.62 |
-1.42 |
0 |
|
|
19637 |
569465 |
1 |
N3O3C20H21 |
A3B3C20D21 |
-62.94 |
4.53 |
-9.32 |
-0.77 |
0 |
|
|
19638 |
569466 |
1 |
N2O2F7H13C19 |
A2B2C7D13E19 |
-343.75 |
9.01 |
-9.84 |
-1.08 |
0 |
|
|
19639 |
569471 |
1 |
NSO2H11C14 |
ABC2D11E14 |
-25.27 |
1.84 |
-8.92 |
-1.42 |
0 |
|
|
19640 |
569512 |
1 |
N2O3H16C19 |
A2B3C16D19 |
-35.78 |
1.76 |
-9.28 |
-0.95 |
0 |
|
|
19641 |
569515 |
2 |
OSH4C6 |
ABC4D6 |
-5.09 |
1.47 |
-9.07 |
-1.36 |
0 |
|
|
19642 |
569524 |
1 |
ON3H9C12 |
AB3C9D12 |
62.42 |
4.38 |
-9.32 |
-0.45 |
0 |
|
|
19643 |
569536 |
1 |
NBr2O3H13C15 |
AB2C3D13E15 |
-37.77 |
3.79 |
-10.36 |
-1.31 |
0 |
|
|
19644 |
569541 |
2 |
O2H5C7 |
A2B5C7 |
-95.99 |
3.47 |
-9.26 |
-0.9 |
0 |
|
|
19645 |
569579 |
1 |
FN3O5H14C22 |
AB3C5D14E22 |
-73.02 |
5.0 |
-9.69 |
-2.31 |
0 |
|
|
19646 |
569580 |
1 |
N2O2H10C15 |
A2B2C10D15 |
44.89 |
3.34 |
-9.79 |
-0.95 |
0 |
|
|
19647 |
569586 |
1 |
OSN3C11H11 |
ABC3D11E11 |
23.33 |
5.67 |
-9.44 |
-1.06 |
0 |
|
|
19648 |
569601 |
2 |
NOH5C7 |
ABC5D7 |
79.23 |
0.43 |
-9.03 |
-1.34 |
0 |
|
|
19649 |
569605 |
1 |
O2C9H10 |
A2B9C10 |
-63.1 |
4.75 |
-10.17 |
-0.8 |
0 |
|
|
19650 |
569606 |
3 |
OH4C5 |
AB4C5 |
-69.48 |
6.14 |
-9.63 |
-1.06 |
0 |
|
|
19651 |
569622 |
1 |
N2O2C13H16 |
A2B2C13D16 |
-54.11 |
3.31 |
-9.33 |
0.01 |
0 |
|
|
19652 |
569647 |
1 |
N2O3H14C16 |
A2B3C14D16 |
15.34 |
4.03 |
-9.63 |
-0.66 |
0 |
|
|
19653 |
569687 |
1 |
SF3N3O5C19H20 |
AB3C3D5E19F20 |
-293.03 |
13.23 |
-9.49 |
-0.89 |
0 |
|
|
19654 |
569696 |
1 |
N2O3F4H16C18 |
A2B3C4D16E18 |
-276.25 |
5.24 |
-9.21 |
-0.52 |
0 |
|
|
19655 |
569727 |
1 |
NO2C12H13 |
AB2C12D13 |
-38.91 |
2.33 |
-9.7 |
-0.47 |
0 |
|
|
19656 |
569734 |
1 |
O10H28C35 |
A10B28C35 |
-291.29 |
7.85 |
-9.94 |
-0.88 |
0 |
|
|
19657 |
569762 |
1 |
NSO3C12H13 |
ABC3D12E13 |
-75.59 |
3.81 |
-10.25 |
-0.89 |
0 |
|
|
19658 |
569872 |
1 |
FO3H11C15 |
AB3C11D15 |
-108.09 |
3.15 |
-10.12 |
-0.81 |
0 |
|
|
19659 |
569904 |
1 |
ClSO2H15C20 |
ABC2D15E20 |
-2.92 |
2.45 |
-9.26 |
-0.87 |
0 |
|
|
19660 |
569933 |
1 |
NO4C18H19 |
AB4C18D19 |
-137.67 |
5.98 |
-9.69 |
-0.57 |
0 |
|
|
19661 |
569934 |
1 |
OSN6C14H14 |
ABC6D14E14 |
47.14 |
3.85 |
-9.13 |
-0.64 |
0 |
|
|
19662 |
569935 |
1 |
OSN3F6H11C17 |
ABC3D6E11F17 |
-268.78 |
5.69 |
-9.41 |
-1.06 |
0 |
|
|
19663 |
569958 |
1 |
NO2C12H13 |
AB2C12D13 |
-58.56 |
5.6 |
-9.53 |
-0.68 |
0 |
|
|
19664 |
569959 |
1 |
ON5C12H15 |
AB5C12D15 |
56.37 |
5.64 |
-9.57 |
-0.53 |
0 |
|
|
19665 |
569960 |
1 |
N3O4H13C17 |
A3B4C13D17 |
-71.46 |
2.75 |
-9.11 |
-1.49 |
0 |
|
|
19666 |
569961 |
1 |
NO2S2H13C19 |
AB2C2D13E19 |
35.61 |
6.2 |
-8.87 |
-1.64 |
0 |
|
|
19667 |
570005 |
1 |
NO3H15C17 |
AB3C15D17 |
-73.01 |
7.9 |
-9.68 |
-0.68 |
0 |
|
|
19668 |
570008 |
1 |
O3N4C14H18 |
A3B4C14D18 |
-28.59 |
7.75 |
-8.7 |
-0.84 |
0 |
|
|
19669 |
570020 |
1 |
OSH20C22 |
ABC20D22 |
45.45 |
2.34 |
-8.91 |
-0.4 |
0 |
|
|
19670 |
570021 |
2 |
OH6C7 |
AB6C7 |
-1.17 |
2.85 |
-9.32 |
-0.6 |
0 |
|
|
19671 |
570023 |
1 |
N2O3H18C21 |
A2B3C18D21 |
12.19 |
4.99 |
-8.77 |
-0.82 |
0 |
|
|
19672 |
570025 |
1 |
BrO2H17C23 |
AB2C17D23 |
19.05 |
5.84 |
-9.64 |
-0.77 |
0 |
|
|
19673 |
570062 |
1 |
ClOSN2C17H17 |
ABCD2E17F17 |
21.73 |
1.54 |
-9.03 |
-0.65 |
0 |
|
|
19674 |
570080 |
1 |
N2O5C12H12 |
A2B5C12D12 |
-140.36 |
5.2 |
-10.28 |
-1.2 |
0 |
|
|
19675 |
570083 |
1 |
NO3C11H13 |
AB3C11D13 |
-101.7 |
3.39 |
-9.64 |
-0.22 |
0 |
|
|
19676 |
570085 |
1 |
SN2O2C10H12 |
AB2C2D10E12 |
-48.0 |
2.27 |
-9.42 |
-0.55 |
0 |
|
|
19677 |
570146 |
1 |
NO2C16H19 |
AB2C16D19 |
-69.76 |
2.13 |
-9.84 |
-0.39 |
0 |
|
|
19678 |
570204 |
2 |
NOC9H9 |
ABC9D9 |
-16.14 |
6.01 |
-9.02 |
-0.43 |
0 |
|
|
19679 |
570235 |
1 |
ClN2O4C14H15 |
AB2C4D14E15 |
-160.6 |
4.71 |
-9.84 |
-1.16 |
0 |
|
|
19680 |
570242 |
1 |
NCl2O3H13C20 |
AB2C3D13E20 |
-61.1 |
5.29 |
-9.24 |
-0.89 |
0 |
|
|
19681 |
570243 |
2 |
NOH10C12 |
ABC10D12 |
2.68 |
3.96 |
-9.13 |
-0.78 |
0 |
|
|
19682 |
570248 |
1 |
NO3H11C16 |
AB3C11D16 |
-46.62 |
1.27 |
-9.03 |
-0.98 |
0 |
|
|
19683 |
570249 |
1 |
O4H14C17 |
A4B14C17 |
-26.87 |
2.0 |
-9.16 |
-1.02 |
0 |
|
|
19684 |
570261 |
1 |
ClOSN3H16C17 |
ABCD3E16F17 |
44.84 |
2.52 |
-8.73 |
-0.7 |
0 |
|
|
19685 |
570349 |
1 |
O7H24C27 |
A7B24C27 |
-210.16 |
4.8 |
-9.58 |
-0.76 |
0 |
|
|
19686 |
570370 |
1 |
O2N5H15C23 |
A2B5C15D23 |
121.05 |
6.91 |
-9.18 |
-1.67 |
0 |
|
|
19687 |
570374 |
1 |
N3O3H17C22 |
A3B3C17D22 |
-20.91 |
5.34 |
-8.31 |
-1.38 |
0 |
|
|
19688 |
570386 |
1 |
NO5H23C24 |
AB5C23D24 |
-122.22 |
2.49 |
-8.72 |
-0.38 |
0 |
|
|
19690 |
570471 |
1 |
N2C11H16 |
A2B11C16 |
63.05 |
4.05 |
-9.75 |
0.4 |
0 |
|
|
19691 |
570512 |
1 |
BrO3C17H17 |
AB3C17D17 |
-74.74 |
2.98 |
-9.57 |
-0.82 |
0 |
|
|
19692 |
570535 |
1 |
N2O3C17H24 |
A2B3C17D24 |
-122.86 |
2.02 |
-9.76 |
-0.21 |
0 |
|
|
19693 |
570545 |
1 |
NO3H11C17 |
AB3C11D17 |
13.74 |
3.58 |
-9.17 |
-1.37 |
0 |
|
|
19694 |
570552 |
2 |
ON2H11C12 |
AB2C11D12 |
96.03 |
2.35 |
-9.29 |
-1.42 |
0 |
|
|
19695 |
570564 |
1 |
NOC17H25 |
ABC17D25 |
-42.0 |
1.5 |
-9.44 |
-0.32 |
0 |
|
|
19696 |
570627 |
2 |
NOC8H9 |
ABC8D9 |
32.83 |
6.08 |
-9.16 |
-1.26 |
0 |
|
|
19697 |
570656 |
2 |
BO4C12H14 |
AB4C12D14 |
-355.92 |
0.86 |
-8.71 |
-1.23 |
0 |
|
|
19698 |
570659 |
1 |
NO2C11H13 |
AB2C11D13 |
-65.51 |
4.32 |
-9.59 |
-0.87 |
0 |
|
|
19699 |
570696 |
1 |
OC13H16 |
AB13C16 |
-18.71 |
2.9 |
-9.72 |
-0.46 |
0 |
|
|
19700 |
570703 |
3 |
C3H4 |
A3B4 |
18.43 |
0.55 |
-9.49 |
1.2 |
0 |
|
|
19701 |
570745 |
1 |
F3N3O3H14C15 |
A3B3C3D14E15 |
-230.48 |
3.59 |
-10.01 |
-0.7 |
0 |
|
|
19702 |
570746 |
1 |
N4O7C40H46 |
A4B7C40D46 |
-229.53 |
7.9 |
-8.75 |
-0.23 |
0 |
|
|
19703 |
570778 |
1 |
C31H38 |
A31B38 |
19.08 |
1.29 |
-8.68 |
0.5 |
0 |
|
|
19704 |
570779 |
1 |
NO3C16H19 |
AB3C16D19 |
-26.8 |
1.97 |
-9.86 |
-0.82 |
0 |
|
|
19705 |
570856 |
1 |
N3O5H19C22 |
A3B5C19D22 |
-68.87 |
10.33 |
-9.41 |
-1.21 |
0 |
|
|
19706 |
570878 |
2 |
O2C7H9 |
A2B7C9 |
-172.7 |
2.56 |
-9.36 |
-0.01 |
0 |
|
|
19707 |
570885 |
2 |
OC6H9 |
AB6C9 |
-88.25 |
2.75 |
-8.75 |
0.38 |
0 |
|
|
19708 |
570887 |
1 |
O4C17H20 |
A4B17C20 |
-149.7 |
3.18 |
-10.12 |
-0.68 |
0 |
|
|
19709 |
570888 |
1 |
SC9H12 |
AB9C12 |
11.5 |
1.44 |
-8.53 |
0.14 |
0 |
|
|
19710 |
570933 |
1 |
NO2C24H29 |
AB2C24D29 |
-54.75 |
5.18 |
-9.36 |
-0.02 |
0 |
|
|
19711 |
571036 |
2 |
ON2C15H16 |
AB2C15D16 |
35.19 |
3.58 |
-8.19 |
-0.52 |
0 |
|
|
19712 |
571045 |
1 |
OC13H16 |
AB13C16 |
-26.92 |
2.18 |
-9.4 |
0.1 |
0 |
|
|
19713 |
571176 |
1 |
NSO2F3H16C19 |
ABC2D3E16F19 |
-202.94 |
2.33 |
-8.15 |
-1.04 |
0 |
|
|
19715 |
571236 |
1 |
ON2H12C16 |
AB2C12D16 |
50.26 |
3.61 |
-9.72 |
-1.07 |
0 |
|
|
19716 |
571246 |
1 |
N2F3O3H19C23 |
A2B3C3D19E23 |
-198.89 |
2.6 |
-8.6 |
-0.82 |
0 |
|
|
19717 |
571253 |
1 |
SN3H13C14 |
AB3C13D14 |
79.52 |
4.59 |
-8.79 |
-0.6 |
0 |
|
|
19718 |
571254 |
1 |
INSO2H16C17 |
ABCD2E16F17 |
-33.36 |
1.4 |
-8.54 |
-1.87 |
0 |
|
|
19719 |
571266 |
1 |
ClNO2H12C14 |
ABC2D12E14 |
-39.27 |
6.41 |
-8.64 |
-0.56 |
0 |
|
|
19720 |
571295 |
1 |
NO3C24H29 |
AB3C24D29 |
-84.78 |
3.71 |
-9.35 |
-1.03 |
0 |
|
|
19721 |
571300 |
1 |
Br2O2C9H10 |
A2B2C9D10 |
-2.67 |
1.03 |
-9.8 |
-0.76 |
0 |
|
|
19722 |
571328 |
1 |
N2O3H14C17 |
A2B3C14D17 |
-9.72 |
2.38 |
-8.5 |
-0.6 |
0 |
|
|
19723 |
571338 |
1 |
NO4C17H17 |
AB4C17D17 |
-86.85 |
3.98 |
-9.32 |
-0.45 |
0 |
|
|
19724 |
571355 |
1 |
N4O5H24C33 |
A4B5C24D33 |
-12.01 |
2.77 |
-8.77 |
-1.56 |
0 |
|
|
19725 |
571359 |
1 |
ClO2N7H22C29 |
AB2C7D22E29 |
73.39 |
7.23 |
-8.49 |
-0.61 |
0 |
|
|
19726 |
571366 |
2 |
BO3C9H9 |
AB3C9D9 |
-321.52 |
0.71 |
-9.68 |
-0.2 |
0 |
|
|
19727 |
571411 |
1 |
IO3H11C15 |
AB3C11D15 |
-41.17 |
3.17 |
-9.51 |
-1.05 |
0 |
|
|
19728 |
571435 |
12 |
OH3C4 |
AB3C4 |
-300.96 |
3.53 |
-9.65 |
-0.71 |
0 |
|
|
19729 |
571448 |
1 |
OS2H20C29 |
AB2C20D29 |
80.63 |
3.12 |
-8.36 |
-1.4 |
0 |
|
|
19730 |
571463 |
1 |
O9C29H34 |
A9B29C34 |
-347.29 |
4.32 |
-8.71 |
-0.97 |
0 |
|
|
19731 |
571464 |
1 |
NSO7H29C34 |
ABC7D29E34 |
-160.61 |
7.03 |
-8.36 |
-0.97 |
0 |
|
|
19732 |
571503 |
1 |
NOSC8H17 |
ABCD8E17 |
-51.2 |
3.07 |
-9.42 |
-0.16 |
0 |
|
|
19733 |
571520 |
2 |
NOC7H7 |
ABC7D7 |
36.56 |
4.77 |
-8.58 |
-1.42 |
0 |
|
|
19734 |
571529 |
1 |
ClSN2O3H9C16 |
ABC2D3E9F16 |
-37.87 |
4.08 |
-9.62 |
-1.67 |
0 |