List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
332331 |
127250617 |
1 |
N3O3C27H31 |
A3B3C27D31 |
-66.11 |
4.33 |
-8.38 |
-0.77 |
0 |
|
|
332332 |
127250618 |
1 |
O2N5C24H29 |
A2B5C24D29 |
-7.1 |
0.68 |
-8.36 |
-0.72 |
0 |
|
|
332333 |
127250619 |
1 |
O3N5C25H25 |
A3B5C25D25 |
-28.65 |
7.13 |
-8.97 |
-0.78 |
0 |
|
|
332334 |
127250620 |
3 |
ON2C8H8 |
AB2C8D8 |
-21.2 |
4.63 |
-8.25 |
-0.86 |
0 |
|
|
332335 |
127250621 |
1 |
O3N5H23C25 |
A3B5C23D25 |
-14.88 |
5.48 |
-9.15 |
-0.75 |
0 |
|
|
332336 |
127250622 |
1 |
FO2N4C23H25 |
AB2C4D23E25 |
-55.22 |
3.02 |
-9.29 |
-0.61 |
0 |
|
|
332337 |
127250623 |
1 |
FO2N4C25H27 |
AB2C4D25E27 |
-67.45 |
4.05 |
-8.9 |
-0.66 |
0 |
|
|
332338 |
127250624 |
2 |
ON2C12H13 |
AB2C12D13 |
-17.34 |
3.28 |
-8.66 |
-0.51 |
0 |
|
|
332339 |
127250625 |
1 |
O3N6C24H28 |
A3B6C24D28 |
-22.02 |
4.54 |
-8.86 |
-0.67 |
0 |
|
|
332340 |
127250626 |
1 |
O3N5C23H27 |
A3B5C23D27 |
-37.48 |
3.43 |
-8.75 |
-0.72 |
0 |
|
|
332341 |
127250627 |
1 |
O3N4C21H24 |
A3B4C21D24 |
-50.9 |
7.72 |
-9.1 |
-0.8 |
0 |
|
|
332342 |
127250628 |
1 |
SN4O4C22H24 |
AB4C4D22E24 |
-76.04 |
7.34 |
-9.29 |
-1.02 |
0 |
|
|
332343 |
127250629 |
1 |
SO3N6C17H18 |
AB3C6D17E18 |
-2.84 |
7.06 |
-9.31 |
-1.12 |
0 |
|
|
332344 |
127250630 |
1 |
O3N4C25H30 |
A3B4C25D30 |
-37.99 |
4.73 |
-8.72 |
-1.1 |
0 |
|
|
332345 |
127250631 |
1 |
O3N5C25H31 |
A3B5C25D31 |
-42.04 |
3.46 |
-8.63 |
-0.7 |
0 |
|
|
332346 |
127250632 |
1 |
FOSN3C20H20 |
ABCD3E20F20 |
-4.63 |
2.65 |
-8.98 |
-0.64 |
0 |
|
|
332347 |
127250633 |
1 |
SO2N3C21H23 |
AB2C3D21E23 |
1.8 |
2.03 |
-8.7 |
-0.41 |
0 |
|
|
332348 |
127250634 |
1 |
OSN5C18H19 |
ABC5D18E19 |
64.8 |
2.87 |
-9.1 |
-1.26 |
0 |
|
|
332349 |
127250635 |
1 |
OSN5C17H19 |
ABC5D17E19 |
61.49 |
3.07 |
-8.91 |
-0.48 |
0 |
|
|
332350 |
127250636 |
1 |
OSN6C18H20 |
ABC6D18E20 |
60.0 |
2.04 |
-8.94 |
-0.75 |
0 |
|
|
332351 |
127250637 |
1 |
N3O3C27H29 |
A3B3C27D29 |
-66.15 |
3.0 |
-9.3 |
-0.78 |
0 |
|
|
332352 |
127250638 |
2 |
FN2O2C11H11 |
AB2C2D11E11 |
-212.15 |
7.49 |
-9.32 |
-0.72 |
0 |
|
|
332353 |
127250639 |
1 |
O3N6C18H20 |
A3B6C18D20 |
3.27 |
4.09 |
-9.16 |
-0.45 |
0 |
|
|
332354 |
127250640 |
1 |
FO2N5C23H24 |
AB2C5D23E24 |
-42.93 |
2.04 |
-8.97 |
-0.73 |
0 |
|
|
332355 |
127250641 |
4 |
NOC6H7 |
ABC6D7 |
-49.49 |
3.24 |
-8.71 |
-0.35 |
0 |
|
|
332356 |
127250642 |
1 |
O3N5C23H27 |
A3B5C23D27 |
-26.04 |
4.64 |
-7.91 |
-0.9 |
0 |
|
|
332357 |
127250643 |
1 |
O3N5C25H29 |
A3B5C25D29 |
-36.83 |
4.67 |
-8.17 |
-0.49 |
0 |
|
|
332358 |
127250644 |
1 |
O3N6C24H28 |
A3B6C24D28 |
-25.03 |
3.44 |
-8.8 |
-0.91 |
0 |
|
|
332359 |
127250645 |
1 |
O3N5C18H23 |
A3B5C18D23 |
-63.46 |
2.52 |
-9.01 |
-0.8 |
0 |
|
|
332360 |
127250646 |
1 |
O3N4C26H26 |
A3B4C26D26 |
-26.24 |
1.49 |
-8.67 |
-0.46 |
0 |
|
|
332361 |
127250647 |
1 |
O3N6C24H26 |
A3B6C24D26 |
-28.54 |
6.21 |
-8.98 |
-0.66 |
0 |
|
|
332362 |
127250648 |
1 |
O3N4C18H20 |
A3B4C18D20 |
-64.96 |
7.03 |
-9.44 |
-1.12 |
0 |
|
|
332363 |
127250649 |
1 |
O3N5C23H29 |
A3B5C23D29 |
-68.33 |
5.03 |
-9.43 |
-0.99 |
0 |
|
|
332364 |
127250650 |
1 |
O3N5C22H29 |
A3B5C22D29 |
-73.66 |
1.67 |
-9.09 |
-0.93 |
0 |
|
|
332365 |
127250651 |
1 |
O3N5C22H27 |
A3B5C22D27 |
-58.37 |
5.53 |
-9.34 |
-1.02 |
0 |
|
|
332366 |
127250652 |
1 |
O3N5C24H31 |
A3B5C24D31 |
-74.69 |
7.09 |
-9.04 |
-1.05 |
0 |
|
|
332367 |
127250653 |
1 |
SO3N6C21H22 |
AB3C6D21E22 |
-8.87 |
3.6 |
-9.54 |
-1.11 |
0 |
|
|
332368 |
127250654 |
2 |
ON3C11H12 |
AB3C11D12 |
6.54 |
3.98 |
-8.85 |
-1.08 |
0 |
|
|
332369 |
127250655 |
2 |
ON3C11H12 |
AB3C11D12 |
7.02 |
3.04 |
-8.93 |
-1.19 |
0 |
|
|
332370 |
127250656 |
1 |
O4N5C22H27 |
A4B5C22D27 |
-97.39 |
3.37 |
-9.16 |
-1.11 |
0 |
|
|
332371 |
127250657 |
1 |
SO3N5C22H23 |
AB3C5D22E23 |
-38.87 |
1.98 |
-9.37 |
-1.18 |
0 |
|
|
332372 |
127250658 |
1 |
O3N6C23H24 |
A3B6C23D24 |
-9.32 |
4.47 |
-9.23 |
-1.06 |
0 |
|
|
332373 |
127250659 |
1 |
O4N5C22H23 |
A4B5C22D23 |
-72.58 |
4.71 |
-9.43 |
-1.13 |
0 |
|
|
332374 |
127250660 |
1 |
N4O4C25H26 |
A4B4C25D26 |
-72.53 |
4.19 |
-9.27 |
-1.09 |
0 |
|
|
332375 |
127250661 |
1 |
FO3N4C25H25 |
AB3C4D25E25 |
-89.81 |
2.62 |
-9.28 |
-0.91 |
0 |
|
|
332376 |
127250662 |
1 |
O3N6C23H24 |
A3B6C23D24 |
-21.41 |
6.19 |
-9.0 |
-1.12 |
0 |
|
|
332377 |
127250663 |
2 |
N2O2C12H15 |
A2B2C12D15 |
-134.0 |
5.22 |
-9.7 |
-1.19 |
0 |
|
|
332378 |
127250664 |
1 |
O3N4C26H28 |
A3B4C26D28 |
-55.28 |
5.89 |
-9.11 |
-1.02 |
0 |
|
|
332379 |
127250665 |
1 |
N4O4C21H26 |
A4B4C21D26 |
-112.49 |
2.02 |
-9.34 |
-1.16 |
0 |
|
|
332380 |
127250666 |
1 |
O3N5C23H29 |
A3B5C23D29 |
-68.66 |
4.93 |
-8.88 |
-1.03 |
0 |