List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
331731 |
127249814 |
1 |
SO3N5C22H25 |
AB3C5D22E25 |
-27.22 |
3.47 |
-9.02 |
-1.14 |
0 |
|
|
331732 |
127249815 |
1 |
SO3N5C21H23 |
AB3C5D21E23 |
-10.88 |
6.84 |
-8.99 |
-1.06 |
0 |
|
|
331733 |
127250017 |
1 |
ClO2N6C20H21 |
AB2C6D20E21 |
30.83 |
11.9 |
-9.81 |
-0.79 |
0 |
|
|
331734 |
127250018 |
1 |
O3N6C22H26 |
A3B6C22D26 |
-1.88 |
3.72 |
-8.66 |
-0.56 |
0 |
|
|
331735 |
127250019 |
1 |
O2F3N6C21H21 |
A2B3C6D21E21 |
-119.25 |
12.92 |
-9.87 |
-0.91 |
0 |
|
|
331736 |
127250020 |
1 |
O2N5C24H29 |
A2B5C24D29 |
-13.5 |
3.11 |
-9.11 |
-0.2 |
0 |
|
|
331737 |
127250021 |
1 |
FO2N5C23H26 |
AB2C5D23E26 |
-50.97 |
4.24 |
-9.49 |
-0.32 |
0 |
|
|
331738 |
127250022 |
1 |
O3N5C25H31 |
A3B5C25D31 |
-49.01 |
3.13 |
-8.75 |
-0.22 |
0 |
|
|
331739 |
127250023 |
1 |
ClN3O3C20H22 |
AB3C3D20E22 |
-91.47 |
9.18 |
-9.41 |
-0.52 |
0 |
|
|
331740 |
127250024 |
1 |
F2N3O3C20H21 |
A2B3C3D20E21 |
-174.63 |
2.64 |
-9.42 |
-0.34 |
0 |
|
|
331741 |
127250025 |
1 |
FON3H24C26 |
ABC3D24E26 |
13.92 |
1.19 |
-8.91 |
-0.6 |
0 |
|
|
331742 |
127250026 |
1 |
ON4C22H26 |
AB4C22D26 |
46.74 |
3.34 |
-8.99 |
0.08 |
0 |
|
|
331743 |
127250027 |
1 |
FON4C21H23 |
ABC4D21E23 |
5.63 |
2.2 |
-8.87 |
-0.16 |
0 |
|
|
331744 |
127250028 |
1 |
ClON4C21H23 |
ABC4D21E23 |
49.2 |
1.6 |
-8.79 |
-0.21 |
0 |
|
|
331745 |
127250029 |
1 |
ClON4C21H23 |
ABC4D21E23 |
40.26 |
3.87 |
-8.84 |
-0.27 |
0 |
|
|
331746 |
127250030 |
1 |
OF3N4C22H23 |
AB3C4D22E23 |
-109.16 |
2.83 |
-8.9 |
-0.61 |
0 |
|
|
331747 |
127250031 |
1 |
O3N4C26H30 |
A3B4C26D30 |
-46.59 |
7.33 |
-8.79 |
-0.02 |
0 |
|
|
331748 |
127250032 |
1 |
F2O2N4C23H26 |
A2B2C4D23E26 |
-108.34 |
3.57 |
-8.62 |
-0.44 |
0 |
|
|
331749 |
127250033 |
1 |
O3N4C25H32 |
A3B4C25D32 |
-60.2 |
4.92 |
-8.52 |
0.01 |
0 |
|
|
331750 |
127250034 |
1 |
FN4O4C23H25 |
AB4C4D23E25 |
-167.67 |
5.5 |
-9.14 |
-0.3 |
0 |
|
|
331751 |
127250035 |
1 |
ClN3O3C23H28 |
AB3C3D23E28 |
-89.2 |
5.14 |
-8.78 |
-0.41 |
0 |
|
|
331752 |
127250036 |
1 |
ClON4C21H23 |
ABC4D21E23 |
40.01 |
2.21 |
-9.06 |
-0.25 |
0 |
|
|
331753 |
127250037 |
1 |
OF3N4C22H23 |
AB3C4D22E23 |
-111.16 |
3.75 |
-9.12 |
-0.64 |
0 |
|
|
331754 |
127250038 |
1 |
ON4C23H28 |
AB4C23D28 |
36.08 |
2.79 |
-8.62 |
-0.05 |
0 |
|
|
331755 |
127250039 |
1 |
ON4C24H30 |
AB4C24D30 |
27.57 |
2.56 |
-8.59 |
0.02 |
0 |
|
|
331756 |
127250040 |
1 |
FON4C23H27 |
ABC4D23E27 |
-11.3 |
2.02 |
-8.61 |
-0.1 |
0 |
|
|
331757 |
127250041 |
1 |
ClON4C23H27 |
ABC4D23E27 |
25.76 |
2.69 |
-8.65 |
-0.13 |
0 |
|
|
331758 |
127250042 |
1 |
ClON4C23H27 |
ABC4D23E27 |
24.88 |
3.48 |
-8.68 |
-0.17 |
0 |
|
|
331759 |
127250043 |
1 |
OF3N4C24H27 |
AB3C4D24E27 |
-125.44 |
2.42 |
-8.65 |
-0.57 |
0 |
|
|
331760 |
127250044 |
1 |
O2N3C27H33 |
A2B3C27D33 |
-21.32 |
1.13 |
-8.43 |
0.1 |
0 |
|
|
331761 |
127250045 |
1 |
SO2N4C22H24 |
AB2C4D22E24 |
-5.77 |
4.98 |
-8.81 |
-0.56 |
0 |
|
|
331762 |
127250046 |
1 |
FSO2N4C22H23 |
ABC2D4E22F23 |
-52.15 |
3.33 |
-8.65 |
-0.45 |
0 |
|
|
331763 |
127250047 |
1 |
N4O4C23H26 |
A4B4C23D26 |
-120.06 |
6.35 |
-9.34 |
-0.21 |
0 |
|
|
331764 |
127250048 |
1 |
FO3N4H21C22 |
AB3C4D21E22 |
-71.4 |
3.65 |
-9.5 |
-1.07 |
0 |
|
|
331765 |
127250049 |
1 |
N4O4C23H24 |
A4B4C23D24 |
-66.1 |
4.47 |
-8.78 |
-1.1 |
0 |
|
|
331766 |
127250050 |
1 |
ClO3N4C23H23 |
AB3C4D23E23 |
-46.83 |
3.03 |
-9.38 |
-0.92 |
0 |
|
|
331767 |
127250051 |
1 |
N4O4C25H28 |
A4B4C25D28 |
-79.79 |
5.49 |
-8.68 |
-0.79 |
0 |
|
|
331768 |
127250052 |
1 |
FO2N3C20H24 |
AB2C3D20E24 |
-80.98 |
2.69 |
-9.12 |
-0.19 |
0 |
|
|
331769 |
127250053 |
3 |
NOC7H9 |
ABC7D9 |
-76.41 |
2.27 |
-8.91 |
-0.22 |
0 |
|
|
331770 |
127250054 |
1 |
O3N5C23H27 |
A3B5C23D27 |
-38.34 |
3.42 |
-8.9 |
-0.34 |
0 |
|
|
331771 |
127250055 |
1 |
ClO2N5C22H24 |
AB2C5D22E24 |
-7.01 |
1.74 |
-9.51 |
-0.27 |
0 |
|
|
331772 |
127250056 |
1 |
N3O3C27H29 |
A3B3C27D29 |
-74.83 |
6.8 |
-9.02 |
-0.68 |
0 |
|
|
331773 |
127250057 |
1 |
O3N4C25H28 |
A3B4C25D28 |
-69.23 |
2.75 |
-9.35 |
-0.52 |
0 |
|
|
331774 |
127250058 |
1 |
O2N4C21H22 |
A2B4C21D22 |
12.93 |
5.82 |
-9.27 |
-0.3 |
0 |
|
|
331775 |
127250059 |
1 |
FO2N4C21H21 |
AB2C4D21E21 |
-34.81 |
3.05 |
-9.26 |
-0.25 |
0 |
|
|
331776 |
127250060 |
1 |
ClO2N4C21H21 |
AB2C4D21E21 |
2.07 |
3.08 |
-9.24 |
-0.23 |
0 |
|
|
331777 |
127250061 |
1 |
O2F3N4H21C22 |
A2B3C4D21E22 |
-148.96 |
1.81 |
-9.27 |
-0.61 |
0 |
|
|
331778 |
127250062 |
1 |
O2N4C23H24 |
A2B4C23D24 |
3.81 |
2.77 |
-8.93 |
-0.33 |
0 |
|
|
331779 |
127250063 |
2 |
ON2C12H13 |
AB2C12D13 |
-4.3 |
3.62 |
-8.94 |
-0.31 |
0 |
|
|
331780 |
127250064 |
1 |
FO2N4C23H23 |
AB2C4D23E23 |
-43.39 |
3.25 |
-8.96 |
-0.35 |
0 |