List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
305739 |
124967341 |
1 |
O2N5C19H25 |
A2B5C19D25 |
-16.43 |
6.08 |
-8.92 |
0.18 |
0 |
|
|
305740 |
124967342 |
1 |
O2N3C17H27 |
A2B3C17D27 |
-111.22 |
3.54 |
-9.07 |
0.63 |
0 |
|
|
305741 |
124967343 |
1 |
O2N3C17H27 |
A2B3C17D27 |
-110.35 |
7.72 |
-9.22 |
0.52 |
0 |
|
|
305742 |
124967410 |
1 |
ClN2O2C27H35 |
AB2C2D27E35 |
-54.37 |
5.83 |
-8.52 |
0.11 |
0 |
|
|
305743 |
124967412 |
1 |
FN3O4C21H26 |
AB3C4D21E26 |
-164.22 |
4.08 |
-9.1 |
-0.35 |
0 |
|
|
305744 |
124967434 |
1 |
ON6C20H22 |
AB6C20D22 |
50.65 |
6.88 |
-9.33 |
-0.9 |
0 |
|
|
305745 |
124967519 |
2 |
ON3C9H12 |
AB3C9D12 |
-23.61 |
6.07 |
-9.9 |
-0.61 |
0 |
|
|
305746 |
124967520 |
2 |
ON3C9H12 |
AB3C9D12 |
-23.46 |
10.11 |
-9.88 |
-0.54 |
0 |
|
|
305747 |
124967535 |
1 |
O3N5C13H15 |
A3B5C13D15 |
-49.85 |
5.16 |
-9.42 |
-1.05 |
0 |
|
|
305748 |
124967553 |
1 |
O3N4C12H18 |
A3B4C12D18 |
-85.81 |
4.01 |
-9.55 |
0.2 |
0 |
|
|
305749 |
124967861 |
1 |
O4N5H23C25 |
A4B5C23D25 |
-9.05 |
3.11 |
-8.62 |
-1.19 |
0 |
|
|
305750 |
124967898 |
1 |
O2N4C23H28 |
A2B4C23D28 |
-11.7 |
5.25 |
-9.38 |
-0.08 |
0 |
|
|
305751 |
124967900 |
1 |
FON3C20H26 |
ABC3D20E26 |
-57.18 |
3.51 |
-9.1 |
0.22 |
0 |
|
|
305752 |
124968019 |
1 |
O3N6C24H26 |
A3B6C24D26 |
-21.18 |
4.25 |
-9.37 |
-1.14 |
0 |
|
|
305753 |
124968022 |
1 |
O3N5C27H31 |
A3B5C27D31 |
-70.8 |
10.01 |
-8.25 |
-0.96 |
0 |
|
|
305754 |
124968171 |
1 |
SO2N5C17H17 |
AB2C5D17E17 |
21.93 |
3.58 |
-9.4 |
-1.3 |
0 |
|
|
305755 |
124968174 |
1 |
O3N5C24H27 |
A3B5C24D27 |
-58.17 |
3.24 |
-8.94 |
-0.58 |
0 |
|
|
305756 |
124968175 |
1 |
S2N4O4C13H16 |
A2B4C4D13E16 |
-97.34 |
8.99 |
-10.03 |
-1.39 |
0 |
|
|
305757 |
124968194 |
1 |
O2N5C17H17 |
A2B5C17D17 |
18.25 |
5.29 |
-9.25 |
-0.82 |
0 |
|
|
305758 |
124968260 |
1 |
N8C17H18 |
A8B17C18 |
132.22 |
3.52 |
-9.07 |
-0.95 |
0 |
|
|
305759 |
124968285 |
1 |
ON4C27H38 |
AB4C27D38 |
-37.74 |
3.35 |
-8.64 |
-0.19 |
0 |
|
|
305760 |
124968329 |
1 |
O2N3C27H27 |
A2B3C27D27 |
20.39 |
2.95 |
-8.69 |
-0.54 |
0 |
|
|
305761 |
124968345 |
1 |
O2N4C29H32 |
A2B4C29D32 |
8.84 |
3.05 |
-8.85 |
-0.22 |
0 |
|
|
305762 |
124968541 |
1 |
SN4O5C19H28 |
AB4C5D19E28 |
-132.89 |
5.02 |
-8.43 |
-0.05 |
0 |
|
|
305763 |
124968542 |
2 |
ON2C7H10 |
AB2C7D10 |
-55.19 |
6.87 |
-8.97 |
-0.59 |
0 |
|
|
305764 |
124968543 |
2 |
ON2C7H10 |
AB2C7D10 |
-55.22 |
6.57 |
-8.97 |
-0.57 |
0 |
|
|
305765 |
124968544 |
1 |
O3N5C17H23 |
A3B5C17D23 |
-80.76 |
5.21 |
-9.63 |
-0.62 |
0 |
|
|
305766 |
124968641 |
1 |
ClFO2N3C23H25 |
ABC2D3E23F25 |
-49.04 |
2.76 |
-8.98 |
-0.21 |
0 |
|
|
305767 |
124968684 |
1 |
ON5C19H27 |
AB5C19D27 |
-12.11 |
5.82 |
-8.99 |
-1.04 |
0 |
|
|
305768 |
124968745 |
2 |
ON3C13H13 |
AB3C13D13 |
41.31 |
4.17 |
-8.79 |
-1.09 |
0 |
|
|
305769 |
124968798 |
1 |
SO2N3C14H23 |
AB2C3D14E23 |
-83.72 |
4.4 |
-8.94 |
-0.43 |
0 |
|
|
305770 |
124968799 |
1 |
SO2N3C14H23 |
AB2C3D14E23 |
-84.48 |
4.59 |
-8.96 |
-0.35 |
0 |
|
|
305771 |
124968804 |
1 |
ON5C17H17 |
AB5C17D17 |
41.08 |
6.33 |
-9.34 |
-0.63 |
0 |
|
|
305772 |
124968853 |
1 |
ON4C19H24 |
AB4C19D24 |
6.69 |
9.01 |
-8.39 |
0.05 |
0 |
|
|
305773 |
124968854 |
1 |
SN3O3C17H19 |
AB3C3D17E19 |
-64.41 |
3.31 |
-9.26 |
-1.01 |
0 |
|
|
305774 |
124968855 |
1 |
SN3O3C17H19 |
AB3C3D17E19 |
-62.97 |
6.25 |
-9.23 |
-1.17 |
0 |
|
|
305775 |
124968856 |
1 |
O2N5C18H25 |
A2B5C18D25 |
-32.37 |
1.76 |
-8.84 |
-0.3 |
0 |
|
|
305777 |
124968874 |
1 |
ON4C18H18 |
AB4C18D18 |
37.7 |
5.47 |
-9.17 |
-1.09 |
0 |
|
|
305778 |
124968876 |
1 |
ON5C23H33 |
AB5C23D33 |
-14.03 |
6.79 |
-8.57 |
-0.53 |
0 |
|
|
305779 |
124968877 |
1 |
FSO3N4C19H21 |
ABC3D4E19F21 |
-82.48 |
6.44 |
-9.29 |
-0.12 |
0 |
|
|
305780 |
124968882 |
2 |
ON2C7H11 |
AB2C7D11 |
-49.1 |
6.85 |
-8.71 |
0.19 |
0 |
|
|
305781 |
124968896 |
1 |
O3N5C14H17 |
A3B5C14D17 |
-60.78 |
12.58 |
-9.5 |
-0.61 |
0 |
|
|
305782 |
124968897 |
1 |
ClON4C22H25 |
ABC4D22E25 |
31.64 |
1.33 |
-8.64 |
-0.21 |
0 |
|
|
305783 |
124968907 |
1 |
O2N5C17H27 |
A2B5C17D27 |
-42.6 |
4.62 |
-8.63 |
-0.28 |
0 |
|
|
305784 |
124968960 |
1 |
ON5C18H25 |
AB5C18D25 |
25.84 |
3.05 |
-8.33 |
-0.84 |
0 |
|
|
305785 |
124968986 |
1 |
ON5C14H19 |
AB5C14D19 |
31.06 |
6.76 |
-9.06 |
-1.03 |
0 |
|
|
305786 |
124969051 |
1 |
O2N4C19H20 |
A2B4C19D20 |
-6.88 |
5.23 |
-9.15 |
-0.84 |
0 |
|
|
305787 |
124969181 |
1 |
SF2O3N5H17C18 |
AB2C3D5E17F18 |
-92.73 |
6.67 |
-9.74 |
-1.31 |
0 |
|
|
305788 |
124969182 |
1 |
SF2O3N5H17C18 |
AB2C3D5E17F18 |
-96.39 |
1.42 |
-9.95 |
-1.47 |
0 |
|
|
305789 |
124969208 |
1 |
O2N4H24C25 |
A2B4C24D25 |
42.58 |
5.13 |
-8.82 |
-0.76 |
0 |