List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
334455 |
127253007 |
1 |
N2O7C22H24 |
A2B7C22D24 |
-221.68 |
2.98 |
-8.36 |
-0.6 |
0 |
|
|
334456 |
127253008 |
1 |
N5O5C24H27 |
A5B5C24D27 |
-157.94 |
8.19 |
-8.2 |
-0.55 |
0 |
|
|
334457 |
127253009 |
1 |
N2O4C25H30 |
A2B4C25D30 |
-128.44 |
4.54 |
-8.31 |
-0.4 |
0 |
|
|
334458 |
127253010 |
1 |
N3O4H21C27 |
A3B4C21D27 |
-24.4 |
3.67 |
-8.22 |
-1.37 |
0 |
|
|
334459 |
127253011 |
1 |
N3O8C31H41 |
A3B8C31D41 |
-292.14 |
4.13 |
-8.42 |
-0.32 |
0 |
|
|
334460 |
127253012 |
1 |
SN2O4H20C24 |
AB2C4D20E24 |
-55.73 |
4.13 |
-8.38 |
-1.4 |
0 |
|
|
334461 |
127253013 |
1 |
N5O7C37H43 |
A5B7C37D43 |
-100.03 |
10.8 |
-8.37 |
-1.08 |
0 |
|
|
334462 |
127253014 |
1 |
ClN2O7C21H25 |
AB2C7D21E25 |
-249.36 |
7.61 |
-8.8 |
-0.34 |
0 |
|
|
334463 |
127253015 |
1 |
ClN5O6C26H26 |
AB5C6D26E26 |
-44.27 |
16.12 |
-7.46 |
-2.38 |
0 |
|
|
334464 |
127253016 |
1 |
SN3O7C23H27 |
AB3C7D23E27 |
-192.93 |
2.67 |
-8.61 |
-0.61 |
0 |
|
|
334465 |
127253017 |
1 |
ClNO8C24H26 |
ABC8D24E26 |
-265.83 |
4.65 |
-8.83 |
-0.48 |
0 |
|
|
334466 |
127253018 |
1 |
O2N3C20H23 |
A2B3C20D23 |
-33.84 |
5.64 |
-8.0 |
-0.3 |
0 |
|
|
334467 |
127253019 |
1 |
N2O5C19H20 |
A2B5C19D20 |
-72.52 |
9.73 |
-8.01 |
-1.26 |
0 |
|
|
334468 |
127253020 |
1 |
SN5O7C35H41 |
AB5C7D35E41 |
-143.38 |
1.06 |
-8.59 |
-1.19 |
0 |
|
|
334469 |
127253021 |
1 |
BrO9H17C26 |
AB9C17D26 |
-269.24 |
3.85 |
-8.88 |
-1.5 |
0 |
|
|
334470 |
127253022 |
1 |
N3O4H21C24 |
A3B4C21D24 |
-36.04 |
3.66 |
-8.41 |
-1.66 |
0 |
|
|
334471 |
127253023 |
1 |
O4N6H28C29 |
A4B6C28D29 |
45.38 |
5.76 |
-8.97 |
-1.05 |
0 |
|
|
334472 |
127253147 |
1 |
N3O6H23C28 |
A3B6C23D28 |
-82.97 |
10.41 |
-9.38 |
-1.3 |
0 |
|
|
334473 |
127253148 |
1 |
ClN3O10C32H32 |
AB3C10D32E32 |
-322.18 |
6.04 |
-8.47 |
-0.87 |
0 |
|
|
334474 |
127253149 |
1 |
ClN3O5H24C25 |
AB3C5D24E25 |
-114.84 |
1.13 |
-8.8 |
-0.68 |
0 |
|
|
334475 |
127253150 |
1 |
N3O7C25H25 |
A3B7C25D25 |
-222.72 |
4.84 |
-8.78 |
-0.77 |
0 |
|
|
334476 |
127253151 |
2 |
N2O3C18H20 |
A2B3C18D20 |
-120.83 |
9.81 |
-8.1 |
-1.08 |
0 |
|
|
334477 |
127253152 |
1 |
N3O5C27H33 |
A3B5C27D33 |
-167.92 |
4.48 |
-8.3 |
-0.46 |
0 |
|
|
334478 |
127253153 |
1 |
SN5O7C38H41 |
AB5C7D38E41 |
-115.58 |
4.07 |
-7.81 |
-0.6 |
0 |
|
|
334479 |
127253154 |
1 |
NO5H21C25 |
AB5C21D25 |
-95.09 |
1.52 |
-8.11 |
-1.44 |
0 |
|
|
334480 |
127253155 |
1 |
ClN3O6C21H22 |
AB3C6D21E22 |
-151.42 |
7.16 |
-8.85 |
-0.5 |
0 |
|
|
334481 |
127253156 |
1 |
ClN5O5H22C24 |
AB5C5D22E24 |
-65.94 |
5.21 |
-8.73 |
-0.77 |
0 |
|
|
334482 |
127253157 |
1 |
Cl2N2O7C38H44 |
A2B2C7D38E44 |
-126.04 |
14.81 |
-5.81 |
-1.87 |
0 |
|
|
334483 |
127253158 |
1 |
N3O5C26H31 |
A3B5C26D31 |
-169.26 |
4.6 |
-8.23 |
-0.74 |
0 |
|
|
334484 |
127253159 |
1 |
ClN4O5C27H29 |
AB4C5D27E29 |
-107.97 |
7.45 |
-8.81 |
-0.94 |
0 |
|
|
334485 |
127253160 |
1 |
ClNSO7C20H22 |
ABCD7E20F22 |
-254.89 |
8.29 |
-8.93 |
-0.59 |
0 |
|
|
334486 |
127253161 |
1 |
ClN3O5C27H28 |
AB3C5D27E28 |
-134.37 |
7.13 |
-8.88 |
-0.58 |
0 |
|
|
334487 |
127253162 |
3 |
NO2C9H11 |
AB2C9D11 |
-166.28 |
6.12 |
-8.53 |
-0.35 |
0 |
|
|
334488 |
127253163 |
1 |
N4O4H22C25 |
A4B4C22D25 |
-73.2 |
6.38 |
-8.72 |
-1.32 |
0 |
|
|
334490 |
127253165 |
1 |
N3O6C22H25 |
A3B6C22D25 |
-209.99 |
7.36 |
-8.4 |
-0.66 |
0 |
|
|
334491 |
127253166 |
1 |
ClNO5C19H20 |
ABC5D19E20 |
-147.49 |
6.92 |
-9.02 |
-0.39 |
0 |
|
|
334492 |
127253167 |
1 |
N3O7C32H43 |
A3B7C32D43 |
-250.22 |
4.69 |
-8.25 |
-0.53 |
0 |
|
|
334493 |
127253168 |
1 |
SN2O4C16H20 |
AB2C4D16E20 |
-147.4 |
7.23 |
-8.47 |
-0.97 |
0 |
|
|
334495 |
127253170 |
2 |
O2N3C11H13 |
A2B3C11D13 |
-55.42 |
5.31 |
-8.07 |
-1.32 |
0 |
|
|
334496 |
127253171 |
1 |
N3O6H17C25 |
A3B6C17D25 |
-41.39 |
2.41 |
-8.43 |
-1.64 |
0 |
|
|
334497 |
127253172 |
1 |
NO6H15C18 |
AB6C15D18 |
-194.23 |
6.84 |
-8.53 |
-0.88 |
0 |
|
|
334498 |
127253173 |
1 |
N3O4C21H23 |
A3B4C21D23 |
-118.38 |
1.84 |
-9.1 |
-0.32 |
0 |
|
|
334499 |
127253174 |
1 |
N3O4C26H33 |
A3B4C26D33 |
-125.44 |
3.37 |
-8.01 |
-0.12 |
0 |
|
|
334500 |
127253175 |
1 |
ClN2O5C28H31 |
AB2C5D28E31 |
-149.63 |
3.69 |
-8.82 |
-0.36 |
0 |
|
|
334501 |
127253176 |
1 |
O7H26C34 |
A7B26C34 |
-176.98 |
6.8 |
-8.79 |
-1.01 |
0 |
|
|
334502 |
127253177 |
1 |
NSO2H13C18 |
ABC2D13E18 |
-6.36 |
3.24 |
-8.85 |
-1.57 |
0 |
|
|
334503 |
127253178 |
1 |
SN2O6C24H28 |
AB2C6D24E28 |
-175.63 |
4.12 |
-8.87 |
-0.43 |
0 |
|
|
334504 |
127253179 |
1 |
O3N5H17C25 |
A3B5C17D25 |
59.21 |
3.64 |
-8.86 |
-1.57 |
0 |
|
|
334505 |
127253180 |
1 |
SN2O4H18C24 |
AB2C4D18E24 |
-61.51 |
2.01 |
-8.93 |
-1.67 |
0 |
|
|
334506 |
127253181 |
1 |
N4O9C26H30 |
A4B9C26D30 |
-326.95 |
4.38 |
-8.65 |
-0.91 |
0 |