List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
307105 |
125267589 |
1 |
ClFSO4N5H23C27 |
ABCD4E5F23G27 |
-39.22 |
4.89 |
-9.43 |
-1.47 |
0 |
|
|
307106 |
125267593 |
1 |
O2N3C23H31 |
A2B3C23D31 |
-85.28 |
3.51 |
-8.64 |
-0.55 |
0 |
|
|
307107 |
125267597 |
2 |
NOC9H12 |
ABC9D12 |
-44.46 |
3.22 |
-8.89 |
-0.44 |
0 |
|
|
307108 |
125267599 |
1 |
ClFSO4N5H23C27 |
ABCD4E5F23G27 |
-44.3 |
3.5 |
-9.41 |
-1.41 |
0 |
|
|
307109 |
125267632 |
1 |
BrO2N7C18H20 |
AB2C7D18E20 |
44.47 |
4.23 |
-9.21 |
-1.07 |
0 |
|
|
307110 |
125267661 |
1 |
ON5C15H23 |
AB5C15D23 |
1.51 |
5.96 |
-7.76 |
-0.06 |
0 |
|
|
307111 |
125267671 |
1 |
N3O3C25H27 |
A3B3C25D27 |
-36.94 |
3.79 |
-9.01 |
-1.11 |
0 |
|
|
307112 |
125267676 |
1 |
ON2H28C36 |
AB2C28D36 |
172.22 |
2.66 |
-8.88 |
-1.1 |
0 |
|
|
307113 |
125267677 |
1 |
FN4O6C33H35 |
AB4C6D33E35 |
-167.04 |
12.0 |
-8.65 |
-0.97 |
0 |
|
|
307114 |
125267680 |
1 |
ON2H28C36 |
AB2C28D36 |
173.81 |
4.84 |
-8.87 |
-1.11 |
0 |
|
|
307115 |
125267683 |
1 |
N4O4H22C23 |
A4B4C22D23 |
-68.33 |
13.52 |
-8.31 |
-1.36 |
0 |
|
|
307116 |
125267684 |
1 |
N4O4H22C23 |
A4B4C22D23 |
-68.28 |
12.97 |
-8.31 |
-1.27 |
0 |
|
|
307117 |
125267689 |
1 |
O5C22H34 |
A5B22C34 |
-175.92 |
2.9 |
-9.86 |
0.47 |
0 |
|
|
307122 |
125269219 |
1 |
NO2H9C11 |
AB2C9D11 |
-34.21 |
4.48 |
-9.97 |
-1.43 |
0 |
|
|
307123 |
125269221 |
1 |
FSO3N4H21C26 |
ABC3D4E21F26 |
-28.94 |
3.02 |
-8.96 |
-2.09 |
0 |
|
|
307124 |
125269222 |
1 |
N5O5H21C23 |
A5B5C21D23 |
-30.04 |
5.09 |
-8.45 |
-1.67 |
0 |
|
|
307125 |
125269223 |
1 |
O3N4C17H18 |
A3B4C17D18 |
-73.77 |
5.32 |
-9.38 |
-0.6 |
0 |
|
|
307126 |
125269224 |
1 |
O2F3N6H15C19 |
A2B3C6D15E19 |
-69.53 |
1.52 |
-9.08 |
-1.56 |
0 |
|
|
307127 |
125269225 |
1 |
N3O3H7C10 |
A3B3C7D10 |
39.14 |
5.56 |
-10.63 |
-2.16 |
0 |
|
|
307128 |
125269237 |
1 |
N4O5C25H26 |
A4B5C25D26 |
-36.38 |
2.31 |
-8.26 |
-1.4 |
0 |
|
|
307129 |
125269269 |
1 |
ClSO3N5H18C20 |
ABC3D5E18F20 |
-44.55 |
2.77 |
-8.73 |
-1.53 |
0 |
|
|
307130 |
125269316 |
1 |
ClON4C18H23 |
ABC4D18E23 |
90.09 |
7.65 |
-8.82 |
-1.58 |
0 |
|
|
307131 |
125269336 |
1 |
FSO2N4C22H25 |
ABC2D4E22F25 |
-41.3 |
5.25 |
-9.21 |
-1.99 |
0 |
|
|
307132 |
125269344 |
1 |
SN3O9C31H49 |
AB3C9D31E49 |
-404.46 |
5.5 |
-9.03 |
-0.71 |
0 |
|
|
307133 |
125270004 |
1 |
O4N6C15H26 |
A4B6C15D26 |
-144.39 |
5.61 |
-9.76 |
-0.48 |
0 |
|
|
307134 |
125270105 |
1 |
N2O5C12H18 |
A2B5C12D18 |
-187.6 |
4.34 |
-10.13 |
-0.65 |
0 |
|
|
307136 |
125270146 |
1 |
ClO2N3H16C19 |
AB2C3D16E19 |
-22.18 |
5.97 |
-9.31 |
-0.63 |
0 |
|
|
307137 |
125270147 |
1 |
O2N5C21H27 |
A2B5C21D27 |
-15.87 |
4.66 |
-8.57 |
-1.06 |
0 |
|
|
307138 |
125270154 |
1 |
SO8N9C23H35 |
AB8C9D23E35 |
-328.49 |
1.57 |
-9.36 |
-0.61 |
0 |
|
|
307139 |
125270160 |
1 |
N6O7C22H28 |
A6B7C22D28 |
-203.55 |
7.89 |
-9.88 |
-1.68 |
0 |
|
|
307140 |
125270167 |
1 |
O2N5C22H25 |
A2B5C22D25 |
-14.66 |
6.79 |
-8.68 |
-0.35 |
0 |
|
|
307141 |
125274978 |
1 |
SO2N3H19C22 |
AB2C3D19E22 |
39.76 |
3.18 |
-8.98 |
-1.97 |
0 |
|
|
307142 |
125275090 |
1 |
OSN4H16C17 |
ABC4D16E17 |
104.4 |
1.92 |
-9.31 |
-1.56 |
0 |
|
|
307143 |
125275091 |
1 |
OSN4H16C17 |
ABC4D16E17 |
107.13 |
2.41 |
-9.21 |
-1.63 |
0 |
|
|
307144 |
125275225 |
1 |
N3O4H17C18 |
A3B4C17D18 |
-109.47 |
3.41 |
-9.77 |
-1.08 |
0 |
|
|
307145 |
125275226 |
1 |
N3O4H17C18 |
A3B4C17D18 |
-105.93 |
4.37 |
-9.67 |
-0.99 |
0 |
|
|
307146 |
125275394 |
1 |
N2O3C12H12 |
A2B3C12D12 |
-52.81 |
5.25 |
-9.66 |
-2.05 |
0 |
|
|
307147 |
125275410 |
1 |
N3O3H17C19 |
A3B3C17D19 |
12.05 |
3.5 |
-8.98 |
-1.02 |
0 |
|
|
307148 |
125275420 |
1 |
ClO2N5H18C20 |
AB2C5D18E20 |
31.51 |
1.88 |
-9.37 |
-0.86 |
0 |
|
|
307149 |
125275423 |
1 |
O3N5C18H23 |
A3B5C18D23 |
-75.88 |
5.4 |
-7.91 |
-1.74 |
0 |
|
|
307150 |
125275429 |
1 |
N3O3C22H25 |
A3B3C22D25 |
-50.0 |
3.7 |
-8.58 |
-1.01 |
0 |
|
|
307151 |
125275495 |
2 |
ON2C9H11 |
AB2C9D11 |
7.61 |
8.01 |
-9.25 |
-1.07 |
0 |
|
|
307152 |
125275500 |
1 |
SO2N5C20H21 |
AB2C5D20E21 |
51.28 |
2.66 |
-8.91 |
-0.82 |
0 |
|
|
307153 |
125275501 |
1 |
O3N5C21H21 |
A3B5C21D21 |
-0.87 |
9.4 |
-9.58 |
-1.25 |
0 |
|
|
307154 |
125275503 |
1 |
FO2N3H14C18 |
AB2C3D14E18 |
63.49 |
10.69 |
-9.0 |
-1.61 |
0 |
|
|
307155 |
125275507 |
2 |
H3N4C5 |
A3B4C5 |
219.09 |
2.06 |
-9.98 |
-2.6 |
0 |
|
|
307156 |
125275509 |
1 |
N3O3H19C20 |
A3B3C19D20 |
3.72 |
7.3 |
-9.17 |
-1.17 |
0 |
|
|
307157 |
125275512 |
1 |
O4N5H11C12 |
A4B5C11D12 |
31.83 |
8.88 |
-9.62 |
-2.02 |
0 |
|
|
307158 |
125275524 |
1 |
SN3O3H17C19 |
AB3C3D17E19 |
-43.52 |
5.85 |
-9.09 |
-1.14 |
0 |
|
|
307159 |
125275529 |
1 |
O2N8C25H28 |
A2B8C25D28 |
29.49 |
6.03 |
-8.63 |
-0.93 |
0 |