List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
317686 |
126645018 |
1 |
O2N5C20H23 |
A2B5C20D23 |
0.85 |
5.44 |
-8.43 |
-0.43 |
0 |
|
|
317687 |
126645022 |
1 |
BrNF3H13C17 |
ABC3D13E17 |
-112.25 |
6.18 |
-8.74 |
-0.83 |
0 |
|
|
317689 |
126645119 |
1 |
N2F3O4H21C22 |
A2B3C4D21E22 |
-265.46 |
1.44 |
-8.86 |
-1.04 |
0 |
|
|
317690 |
126645134 |
1 |
N2O3C21H22 |
A2B3C21D22 |
-52.71 |
3.09 |
-7.99 |
-0.26 |
0 |
|
|
317692 |
126645157 |
1 |
NF3O3H22C24 |
AB3C3D22E24 |
-210.41 |
6.96 |
-8.78 |
-0.88 |
0 |
|
|
317696 |
126645200 |
1 |
N2O3C25H32 |
A2B3C25D32 |
-98.38 |
1.43 |
-8.06 |
0.21 |
0 |
|
|
317697 |
126645201 |
1 |
F3O3N5H16C18 |
A3B3C5D16E18 |
-163.76 |
2.73 |
-8.82 |
-1.1 |
0 |
|
|
317698 |
126645202 |
1 |
N2O5C20H20 |
A2B5C20D20 |
-110.12 |
3.65 |
-8.92 |
-0.8 |
0 |
|
|
317700 |
126645205 |
1 |
NO5C16H20 |
AB5C16D20 |
-104.2 |
6.94 |
0.0 |
0.0 |
0 |
|
|
317702 |
126645207 |
1 |
ClN2O5H15C17 |
AB2C5D15E17 |
-121.1 |
3.99 |
-9.0 |
-1.11 |
0 |
|
|
317703 |
126645208 |
2 |
NO2C9H10 |
AB2C9D10 |
-82.5 |
6.6 |
-8.76 |
-0.5 |
0 |
|
|
317704 |
126645209 |
1 |
N2O3C16H22 |
A2B3C16D22 |
-83.51 |
5.02 |
-8.65 |
-0.43 |
0 |
|
|
317705 |
126645210 |
1 |
NO2C27H35 |
AB2C27D35 |
-78.31 |
1.48 |
-8.45 |
0.43 |
0 |
|
|
317706 |
126645211 |
1 |
O2F3N3C25H28 |
A2B3C3D25E28 |
-178.55 |
7.03 |
-8.48 |
-0.44 |
0 |
|
|
317707 |
126645212 |
1 |
N3O4C17H17 |
A3B4C17D17 |
-72.29 |
4.57 |
-9.02 |
-0.94 |
0 |
|
|
317708 |
126645221 |
1 |
N2O2F3C24H25 |
A2B2C3D24E25 |
-191.56 |
6.77 |
-8.55 |
-0.51 |
0 |
|
|
317709 |
126645243 |
1 |
ClN2O2C22H23 |
AB2C2D22E23 |
-39.59 |
3.73 |
-8.15 |
-0.13 |
0 |
|
|
317711 |
126645279 |
1 |
OF3N5C28H34 |
AB3C5D28E34 |
-138.39 |
6.83 |
-8.58 |
-0.64 |
0 |
|
|
317712 |
126645327 |
1 |
NaN2O2C22H25 |
AB2C2D22E25 |
-85.68 |
9.66 |
-7.67 |
0.28 |
0 |
|
|
317713 |
126645328 |
1 |
SN2O6C15H20 |
AB2C6D15E20 |
-202.02 |
1.34 |
-8.88 |
-0.78 |
0 |
|
|
317714 |
126645344 |
1 |
NF3O4C20H20 |
AB3C4D20E20 |
-268.61 |
8.3 |
-9.1 |
-0.63 |
0 |
|
|
317715 |
126645346 |
1 |
N2O3C26H32 |
A2B3C26D32 |
-82.25 |
2.04 |
-8.16 |
0.09 |
0 |
|
|
317717 |
126645356 |
1 |
N2F3O4H21C22 |
A2B3C4D21E22 |
-269.12 |
3.73 |
-8.86 |
-0.9 |
0 |
|
|
317718 |
126645367 |
1 |
F3O4N5H10C16 |
A3B4C5D10E16 |
-130.16 |
4.76 |
-9.39 |
-1.88 |
0 |
|
|
317720 |
126645372 |
3 |
NO2H5C6 |
AB2C5D6 |
-119.22 |
2.94 |
-9.19 |
-1.1 |
0 |
|
|
317723 |
126645414 |
2 |
NO2C9H9 |
AB2C9D9 |
-86.27 |
9.13 |
-8.9 |
-0.53 |
0 |
|
|
317726 |
126645438 |
1 |
N2O3C22H26 |
A2B3C22D26 |
-83.11 |
1.33 |
-8.06 |
0.22 |
0 |
|
|
317730 |
126645560 |
1 |
F3N3O3H6C10 |
A3B3C3D6E10 |
-196.79 |
6.68 |
-10.15 |
-1.75 |
0 |
|
|
317731 |
126645569 |
1 |
NO6H15C18 |
AB6C15D18 |
-192.06 |
6.17 |
-9.33 |
-1.14 |
0 |
|
|
317732 |
126645580 |
1 |
N3O5C22H25 |
A3B5C22D25 |
-127.78 |
4.35 |
-8.75 |
-0.73 |
0 |
|
|
317733 |
126645581 |
1 |
N2O5C18H18 |
A2B5C18D18 |
-119.22 |
4.08 |
-9.0 |
-0.9 |
0 |
|
|
317734 |
126645582 |
1 |
N3O5C22H23 |
A3B5C22D23 |
-125.15 |
2.67 |
-9.17 |
-1.04 |
0 |
|
|
317736 |
126645592 |
1 |
O2F3N3H6C10 |
A2B3C3D6E10 |
-143.5 |
3.77 |
-9.87 |
-1.47 |
0 |
|
|
317737 |
126645593 |
1 |
F3O3N7H10C17 |
A3B3C7D10E17 |
-97.22 |
8.11 |
-9.41 |
-1.64 |
0 |
|
|
317738 |
126645594 |
1 |
ON2C6H10 |
AB2C6D10 |
-29.91 |
3.73 |
-9.72 |
0.99 |
0 |
|
|
317740 |
126645598 |
1 |
NO5C12H21 |
AB5C12D21 |
-272.06 |
4.61 |
-10.12 |
0.51 |
0 |
|
|
317741 |
126645608 |
1 |
NaN2O3C24H29 |
AB2C3D24E29 |
-75.97 |
35.71 |
-7.01 |
-1.16 |
0 |
|
|
317742 |
126645611 |
2 |
ClNO2H8C9 |
ABC2D8E9 |
-104.76 |
4.05 |
-9.16 |
-0.88 |
0 |
|
|
317743 |
126645613 |
1 |
NO4C25H29 |
AB4C25D29 |
-139.29 |
1.39 |
-8.36 |
-0.32 |
0 |
|
|
317744 |
126645614 |
1 |
N2O5C18H18 |
A2B5C18D18 |
-120.41 |
1.47 |
-8.99 |
-0.84 |
0 |
|
|
317745 |
126645633 |
1 |
N2F3O3H15C17 |
A2B3C3D15E17 |
-194.2 |
3.98 |
-9.02 |
-0.63 |
0 |
|
|
317747 |
126645641 |
1 |
SF3O3N8H27C29 |
AB3C3D8E27F29 |
-146.06 |
1.67 |
-8.86 |
-1.12 |
0 |
|
|
317748 |
126645642 |
1 |
SF3O3N7H28C30 |
AB3C3D7E28F30 |
-157.07 |
3.18 |
-8.77 |
-1.01 |
0 |
|
|
317751 |
126645659 |
1 |
N2F4O4H12C17 |
A2B4C4D12E17 |
-277.93 |
3.01 |
-9.37 |
-1.2 |
0 |
|
|
317752 |
126645667 |
1 |
ClFN2O4H16C18 |
ABC2D4E16F18 |
-144.67 |
3.39 |
-9.14 |
-0.84 |
0 |
|
|
317753 |
126645668 |
1 |
O2F5N6H21C22 |
A2B5C6D21E22 |
-237.52 |
5.91 |
-9.21 |
-1.34 |
0 |
|
|
317755 |
126645676 |
2 |
NSO3C9H10 |
ABC3D9E10 |
-163.2 |
3.7 |
-9.36 |
-1.35 |
0 |
|
|
317756 |
126645681 |
1 |
N4O4H14C17 |
A4B4C14D17 |
-40.39 |
5.06 |
-9.01 |
-0.94 |
0 |
|
|
317757 |
126645685 |
1 |
SN2O5C17H18 |
AB2C5D17E18 |
-118.34 |
3.43 |
-8.72 |
-0.71 |
0 |
|
|
317758 |
126645687 |
2 |
NO2H5C6 |
AB2C5D6 |
-38.59 |
2.51 |
-9.23 |
-1.13 |
0 |
|
|
317759 |
126645689 |
1 |
N3O5H15C19 |
A3B5C15D19 |
-73.21 |
5.02 |
-9.19 |
-1.04 |
0 |
|
|
317760 |
126645690 |
2 |
NO2H10C11 |
AB2C10D11 |
-73.19 |
2.02 |
-9.01 |
-0.79 |
0 |
|
|
317762 |
126645698 |
1 |
NO5H17C18 |
AB5C17D18 |
-150.55 |
6.23 |
-8.96 |
-0.9 |
0 |
|
|
317763 |
126645699 |
1 |
N3O5H19C20 |
A3B5C19D20 |
-120.23 |
4.59 |
-8.71 |
-0.91 |
0 |
|
|
317765 |
126645708 |
1 |
ClFN2O4H12C16 |
ABC2D4E12F16 |
-126.67 |
3.02 |
-9.29 |
-1.04 |
0 |
|
|
317766 |
126645711 |
1 |
ClSF3O4N7H25C29 |
ABC3D4E7F25G29 |
-192.58 |
5.1 |
-8.27 |
-1.28 |
0 |
|
|
317768 |
126645713 |
1 |
ClNSO4F7H25C27 |
ABCD4E7F25G27 |
-469.88 |
7.95 |
-9.59 |
-1.3 |
0 |
|
|
317769 |
126645714 |
1 |
F3O3N7H12C18 |
A3B3C7D12E18 |
-92.1 |
8.94 |
-9.3 |
-1.51 |
0 |
|
|
317770 |
126645717 |
1 |
F3O3N4H13C17 |
A3B3C4D13E17 |
-175.35 |
5.54 |
-9.06 |
-1.18 |
0 |
|
|
317771 |
126645718 |
1 |
ClFN2O4H12C16 |
ABC2D4E12F16 |
-127.02 |
3.25 |
-9.34 |
-1.04 |
0 |
|
|
317772 |
126645724 |
1 |
NSO4F6C29H31 |
ABC4D6E29F31 |
-425.41 |
6.86 |
-9.22 |
-0.92 |
0 |
|
|
317773 |
126645725 |
1 |
SF3O5N7H28C30 |
AB3C5D7E28F30 |
-220.58 |
2.06 |
-8.47 |
-1.05 |
0 |
|
|
317775 |
126645727 |
1 |
F3O3N5H14C17 |
A3B3C5D14E17 |
-162.46 |
3.24 |
-9.01 |
-1.15 |
0 |
|
|
317776 |
126645731 |
1 |
ClN3O4H26C27 |
AB3C4D26E27 |
-60.53 |
5.85 |
-8.96 |
-0.93 |
0 |
|
|
317779 |
126645743 |
1 |
ClN3O5H12C17 |
AB3C5D12E17 |
-87.52 |
2.45 |
-9.3 |
-1.34 |
0 |
|
|
317780 |
126645745 |
1 |
N2O5C18H18 |
A2B5C18D18 |
-120.42 |
1.48 |
-9.0 |
-0.83 |
0 |
|
|
317781 |
126645746 |
2 |
NO2C10H11 |
AB2C10D11 |
-96.57 |
1.41 |
-9.05 |
-0.91 |
0 |
|
|
317782 |
126645747 |
1 |
N3O4H15C18 |
A3B4C15D18 |
-56.13 |
2.37 |
-8.72 |
-0.78 |
0 |
|
|
317783 |
126645748 |
2 |
NO2C10H11 |
AB2C10D11 |
-107.59 |
2.55 |
-8.94 |
-0.76 |
0 |
|
|
317784 |
126645749 |
1 |
NO5C19H19 |
AB5C19D19 |
-158.69 |
2.91 |
-8.93 |
-0.86 |
0 |
|
|
317787 |
126645764 |
1 |
O3F4N4H12C17 |
A3B4C4D12E17 |
-228.32 |
10.74 |
-9.13 |
-1.56 |
0 |
|
|
317788 |
126645765 |
1 |
N2O5C21H24 |
A2B5C21D24 |
-137.37 |
4.44 |
-8.88 |
-0.79 |
0 |
|
|
317789 |
126645766 |
1 |
N4O4H16C19 |
A4B4C16D19 |
-32.94 |
4.36 |
-9.32 |
-1.06 |
0 |
|
|
317790 |
126645767 |
1 |
N3O5H19C20 |
A3B5C19D20 |
-105.77 |
5.43 |
-9.06 |
-0.89 |
0 |
|
|
317792 |
126645769 |
1 |
FSO2N5C17H18 |
ABC2D5E17F18 |
-40.32 |
6.97 |
-8.53 |
-0.83 |
0 |