List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
421736 |
135116518 |
1 |
ON3C16H17 |
AB3C16D17 |
5.01 |
3.7 |
-9.32 |
-0.62 |
0 |
|
|
421737 |
135116519 |
1 |
O2N5C20H23 |
A2B5C20D23 |
-14.39 |
8.77 |
-8.02 |
-0.6 |
0 |
|
|
421738 |
135116520 |
2 |
ON2C8H9 |
AB2C8D9 |
-20.94 |
2.5 |
-9.76 |
-0.74 |
0 |
|
|
421739 |
135116521 |
1 |
ON5C18H21 |
AB5C18D21 |
68.75 |
2.28 |
-8.55 |
-1.14 |
0 |
|
|
421740 |
135116522 |
1 |
OSN3C17H23 |
ABC3D17E23 |
5.66 |
0.66 |
-8.84 |
-0.23 |
0 |
|
|
421741 |
135116523 |
1 |
N2O3C19H22 |
A2B3C19D22 |
-92.84 |
5.26 |
-8.92 |
-0.29 |
0 |
|
|
421742 |
135116524 |
2 |
ON2C10H10 |
AB2C10D10 |
42.85 |
4.51 |
-8.58 |
-0.8 |
0 |
|
|
421743 |
135116525 |
2 |
N3C10H14 |
A3B10C14 |
89.73 |
7.28 |
-8.59 |
-0.22 |
0 |
|
|
421744 |
135116526 |
2 |
N3O3C17H20 |
A3B3C17D20 |
-149.09 |
7.61 |
-9.47 |
-0.85 |
0 |
|
|
421745 |
135116527 |
1 |
ClN2O3C16H17 |
AB2C3D16E17 |
-59.84 |
1.8 |
-9.01 |
-1.46 |
0 |
|
|
421746 |
135116528 |
1 |
NO2C21H33 |
AB2C21D33 |
-94.2 |
2.89 |
-8.46 |
0.4 |
0 |
|
|
421747 |
135116529 |
1 |
N3O3C17H23 |
A3B3C17D23 |
-103.86 |
6.05 |
-9.4 |
-0.86 |
0 |
|
|
421748 |
135116533 |
1 |
N2O4C21H26 |
A2B4C21D26 |
-141.0 |
6.06 |
-9.01 |
0.09 |
0 |
|
|
421749 |
135116536 |
1 |
ClFNSO4C16H21 |
ABCDE4F16G21 |
-224.11 |
5.82 |
-9.65 |
-0.98 |
0 |
|
|
421750 |
135116537 |
1 |
NO4C15H17 |
AB4C15D17 |
-135.57 |
5.35 |
-9.31 |
-0.73 |
0 |
|
|
421751 |
135116538 |
2 |
ON2C10H14 |
AB2C10D14 |
-36.16 |
6.0 |
-8.91 |
-0.23 |
0 |
|
|
421752 |
135116540 |
1 |
ClN5O6H28C31 |
AB5C6D28E31 |
-119.95 |
7.26 |
-9.17 |
-0.97 |
0 |
|
|
421753 |
135116541 |
1 |
O3N5C16H19 |
A3B5C16D19 |
-7.02 |
4.33 |
-8.84 |
-0.17 |
0 |
|
|
421754 |
135116543 |
1 |
NO5C17H25 |
AB5C17D25 |
-206.68 |
5.2 |
-8.27 |
0.1 |
0 |
|
|
421756 |
135116548 |
1 |
N3O3C18H23 |
A3B3C18D23 |
-38.2 |
5.02 |
-9.57 |
-0.53 |
0 |
|
|
421757 |
135116549 |
1 |
O2N5C17H27 |
A2B5C17D27 |
-45.13 |
6.28 |
-9.0 |
-0.73 |
0 |
|
|
421758 |
135116550 |
1 |
ON4C22H26 |
AB4C22D26 |
31.33 |
3.3 |
-9.2 |
-0.74 |
0 |
|
|
421759 |
135116551 |
1 |
O2N3C18H21 |
A2B3C18D21 |
-21.01 |
6.3 |
-9.01 |
-0.82 |
0 |
|
|
421760 |
135116552 |
1 |
O2N5C13H21 |
A2B5C13D21 |
-23.12 |
8.07 |
-9.8 |
-0.38 |
0 |
|
|
421761 |
135116553 |
1 |
O2N5C16H19 |
A2B5C16D19 |
-22.99 |
5.17 |
-9.62 |
-1.08 |
0 |
|
|
421762 |
135116554 |
1 |
O3N5C19H23 |
A3B5C19D23 |
-51.86 |
4.64 |
-9.37 |
-1.06 |
0 |
|
|
421763 |
135116555 |
1 |
S2N4O5C11H14 |
A2B4C5D11E14 |
-93.84 |
5.79 |
-9.66 |
-1.16 |
0 |
|
|
421764 |
135116556 |
1 |
ON8C18H24 |
AB8C18D24 |
84.87 |
5.09 |
-9.16 |
-0.43 |
0 |
|
|
421768 |
135116560 |
1 |
O3N5C15H17 |
A3B5C15D17 |
-51.13 |
5.31 |
-9.22 |
-0.57 |
0 |
|
|
421769 |
135116561 |
1 |
NSO7C18H25 |
ABC7D18E25 |
-255.5 |
8.6 |
-9.12 |
-0.78 |
0 |
|
|
421770 |
135116562 |
1 |
F3O4N5C29H34 |
A3B4C5D29E34 |
-251.83 |
6.03 |
-8.69 |
-0.66 |
0 |
|
|
421771 |
135116564 |
1 |
NO6C16H17 |
AB6C16D17 |
-206.26 |
7.52 |
-9.09 |
-0.71 |
0 |
|
|
421772 |
135116566 |
1 |
N2S2O5C15H24 |
A2B2C5D15E24 |
-198.97 |
3.84 |
-9.7 |
-0.55 |
0 |
|
|
421773 |
135116567 |
1 |
O4N5C28H35 |
A4B5C28D35 |
-31.2 |
2.5 |
-7.83 |
-0.34 |
0 |
|
|
421774 |
135116570 |
1 |
O3N5C19H27 |
A3B5C19D27 |
-34.53 |
5.48 |
-8.72 |
-0.17 |
0 |
|
|
421775 |
135116598 |
1 |
FN2O3C22H33 |
AB2C3D22E33 |
-188.4 |
2.31 |
-8.77 |
0.08 |
0 |
|
|
421776 |
135116599 |
1 |
SN4O4C17H24 |
AB4C4D17E24 |
-147.86 |
5.22 |
-9.57 |
-0.35 |
0 |
|
|
421777 |
135116600 |
1 |
O5N7C33H43 |
A5B7C33D43 |
-168.69 |
11.03 |
-8.69 |
-0.38 |
0 |
|
|
421778 |
135116601 |
1 |
ON6C20H24 |
AB6C20D24 |
34.85 |
4.98 |
-8.67 |
-0.27 |
0 |
|
|
421779 |
135116602 |
1 |
ON5C21H27 |
AB5C21D27 |
30.25 |
5.13 |
-8.79 |
-0.11 |
0 |
|
|
421780 |
135116603 |
1 |
SO2N3C19H21 |
AB2C3D19E21 |
-33.52 |
1.85 |
-9.56 |
-1.33 |
0 |
|
|
421781 |
135116604 |
1 |
NO4C21H31 |
AB4C21D31 |
-164.32 |
4.79 |
-8.4 |
0.31 |
0 |
|
|
421782 |
135116605 |
1 |
ClN3O3C21H24 |
AB3C3D21E24 |
-40.27 |
5.26 |
-9.29 |
-1.07 |
0 |
|
|
421783 |
135116606 |
1 |
O2N3C20H27 |
A2B3C20D27 |
-63.65 |
4.22 |
-9.34 |
-0.07 |
0 |
|
|
421784 |
135116607 |
1 |
NO4C19H27 |
AB4C19D27 |
-152.41 |
2.95 |
-8.66 |
0.0 |
0 |
|
|
421785 |
135116608 |
1 |
ClN2O3C21H31 |
AB2C3D21E31 |
-135.18 |
1.97 |
-8.37 |
-0.03 |
0 |
|
|
421786 |
135116609 |
2 |
ON2C10H16 |
AB2C10D16 |
-90.17 |
2.08 |
-8.72 |
0.98 |
0 |
|
|
421787 |
135116611 |
1 |
ON3C20H21 |
AB3C20D21 |
73.55 |
4.83 |
-9.08 |
-0.72 |
0 |
|
|
421788 |
135116617 |
1 |
O2N3C19H27 |
A2B3C19D27 |
-75.05 |
4.62 |
-8.7 |
-0.01 |
0 |
|
|
421789 |
135116618 |
1 |
O2N5C18H23 |
A2B5C18D23 |
-32.85 |
8.01 |
-8.66 |
0.15 |
0 |