List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
361689 |
127304404 |
1 |
O3N7C18H27 |
A3B7C18D27 |
-29.01 |
3.45 |
-9.27 |
-0.4 |
0 |
|
|
361690 |
127304405 |
1 |
O2N7C20H25 |
A2B7C20D25 |
47.54 |
6.06 |
-8.84 |
-0.69 |
0 |
|
|
361691 |
127304406 |
1 |
O2N5C19H23 |
A2B5C19D23 |
20.24 |
3.89 |
-8.6 |
-0.34 |
0 |
|
|
361692 |
127304407 |
1 |
O3N5C19H31 |
A3B5C19D31 |
-100.8 |
2.7 |
-9.2 |
-0.34 |
0 |
|
|
361693 |
127304408 |
1 |
O3N5C19H31 |
A3B5C19D31 |
-98.52 |
4.86 |
-9.32 |
-0.42 |
0 |
|
|
361694 |
127304409 |
1 |
O3N4C15H24 |
A3B4C15D24 |
-82.39 |
4.71 |
-9.32 |
-0.38 |
0 |
|
|
361695 |
127304410 |
1 |
SO2N6C17H20 |
AB2C6D17E20 |
51.22 |
5.47 |
-9.13 |
-1.0 |
0 |
|
|
361696 |
127304411 |
1 |
O4N6C19H22 |
A4B6C19D22 |
-84.36 |
3.79 |
-9.24 |
-0.91 |
0 |
|
|
361697 |
127304412 |
1 |
FO2N4C21H27 |
AB2C4D21E27 |
-52.47 |
4.26 |
-9.11 |
-0.24 |
0 |
|
|
361698 |
127304413 |
2 |
ON2C7H11 |
AB2C7D11 |
-16.85 |
2.43 |
-9.33 |
-0.43 |
0 |
|
|
361699 |
127304414 |
1 |
O3N4C16H26 |
A3B4C16D26 |
-88.93 |
5.09 |
-9.28 |
-0.18 |
0 |
|
|
361700 |
127304415 |
1 |
O4N5C20H25 |
A4B5C20D25 |
-87.64 |
3.99 |
-8.66 |
-0.48 |
0 |
|
|
361701 |
127304416 |
1 |
FO3N5C19H22 |
AB3C5D19E22 |
-98.88 |
3.45 |
-9.4 |
-0.66 |
0 |
|
|
361702 |
127304417 |
1 |
O3N5C21H29 |
A3B5C21D29 |
-70.1 |
8.77 |
-9.01 |
-0.33 |
0 |
|
|
361703 |
127304418 |
2 |
ON3C10H16 |
AB3C10D16 |
-25.19 |
2.18 |
-8.9 |
-0.22 |
0 |
|
|
361704 |
127304419 |
1 |
ClO2N5C19H22 |
AB2C5D19E22 |
10.14 |
2.83 |
-8.69 |
-0.42 |
0 |
|
|
361705 |
127304420 |
1 |
SO3N5C17H27 |
AB3C5D17E27 |
-68.85 |
4.67 |
-9.05 |
-0.39 |
0 |
|
|
361706 |
127304421 |
1 |
O2N6C17H20 |
A2B6C17D20 |
36.3 |
3.97 |
-9.27 |
-0.94 |
0 |
|
|
361707 |
127304522 |
1 |
O3N4C19H30 |
A3B4C19D30 |
-126.23 |
2.7 |
-9.13 |
0.47 |
0 |
|
|
361708 |
127304523 |
1 |
N3O4C18H29 |
A3B4C18D29 |
-155.88 |
3.04 |
-9.02 |
0.33 |
0 |
|
|
361709 |
127304524 |
1 |
O3N4C19H30 |
A3B4C19D30 |
-128.88 |
3.56 |
-9.03 |
0.26 |
0 |
|
|
361710 |
127304525 |
1 |
SO2N6C17H26 |
AB2C6D17E26 |
-22.75 |
4.35 |
-8.94 |
-0.34 |
0 |
|
|
361711 |
127304526 |
1 |
O3N5C20H25 |
A3B5C20D25 |
-21.01 |
3.13 |
-9.01 |
-1.36 |
0 |
|
|
361712 |
127304527 |
1 |
N3O4C21H27 |
A3B4C21D27 |
-120.69 |
6.13 |
-8.78 |
-0.03 |
0 |
|
|
361713 |
127304528 |
1 |
O3N5C21H27 |
A3B5C21D27 |
-78.63 |
5.19 |
-9.09 |
-1.12 |
0 |
|
|
361714 |
127304529 |
1 |
N3O4C20H25 |
A3B4C20D25 |
-110.35 |
8.03 |
-8.85 |
-0.5 |
0 |
|
|
361715 |
127304530 |
1 |
SO2N7C15H23 |
AB2C7D15E23 |
15.07 |
4.56 |
-9.05 |
-0.82 |
0 |
|
|
361716 |
127304531 |
1 |
O3N4C20H32 |
A3B4C20D32 |
-136.62 |
5.69 |
-8.86 |
0.34 |
0 |
|
|
361717 |
127304532 |
1 |
O3N4C21H34 |
A3B4C21D34 |
-134.67 |
2.38 |
-9.12 |
0.64 |
0 |
|
|
361718 |
127304533 |
1 |
O3N4C20H32 |
A3B4C20D32 |
-134.14 |
7.09 |
-8.84 |
0.57 |
0 |
|
|
361719 |
127304534 |
1 |
O2N5C21H33 |
A2B5C21D33 |
-56.23 |
9.03 |
-8.72 |
0.19 |
0 |
|
|
361720 |
127304535 |
1 |
SN4O4C16H26 |
AB4C4D16E26 |
-144.84 |
5.09 |
-9.07 |
0.18 |
0 |
|
|
361721 |
127304536 |
1 |
O4N5C20H23 |
A4B5C20D23 |
-118.15 |
6.89 |
-8.87 |
-1.16 |
0 |
|
|
361722 |
127304537 |
1 |
N3O3C17H27 |
A3B3C17D27 |
-122.33 |
5.44 |
-8.85 |
0.64 |
0 |
|
|
361723 |
127304538 |
1 |
O2N5C17H23 |
A2B5C17D23 |
-2.05 |
8.14 |
-8.78 |
-0.12 |
0 |
|
|
361724 |
127304539 |
1 |
O3N4C22H26 |
A3B4C22D26 |
-58.25 |
6.69 |
-8.9 |
-1.05 |
0 |
|
|
361725 |
127304540 |
1 |
O2N4C21H26 |
A2B4C21D26 |
-34.7 |
5.6 |
-8.62 |
-0.34 |
0 |
|
|
361726 |
127304541 |
1 |
O3N4C22H30 |
A3B4C22D30 |
-106.95 |
7.71 |
-8.82 |
-0.32 |
0 |
|
|
361727 |
127304542 |
1 |
O2N4C21H26 |
A2B4C21D26 |
-23.77 |
4.42 |
-8.47 |
0.06 |
0 |
|
|
361728 |
127304543 |
1 |
O3N4C21H34 |
A3B4C21D34 |
-128.8 |
8.02 |
-8.94 |
0.71 |
0 |
|
|
361729 |
127304544 |
1 |
ClO2N4C20H23 |
AB2C4D20E23 |
-24.21 |
5.37 |
-8.91 |
-0.58 |
0 |
|
|
361730 |
127304546 |
1 |
O2N6C21H28 |
A2B6C21D28 |
-4.35 |
5.18 |
-8.91 |
-0.98 |
0 |
|
|
361731 |
127304547 |
1 |
SN3O4C17H27 |
AB3C4D17E27 |
-159.26 |
5.44 |
-8.75 |
0.08 |
0 |
|
|
361732 |
127304548 |
1 |
O2N5C19H29 |
A2B5C19D29 |
-46.37 |
9.26 |
-8.72 |
0.16 |
0 |
|
|
361733 |
127304549 |
1 |
N3O3C17H27 |
A3B3C17D27 |
-118.4 |
4.86 |
-8.9 |
0.37 |
0 |
|
|
361734 |
127304550 |
1 |
O2N4C23H30 |
A2B4C23D30 |
-39.97 |
5.45 |
-8.85 |
-0.69 |
0 |
|
|
361735 |
127304551 |
1 |
O2N5C21H29 |
A2B5C21D29 |
-31.91 |
2.22 |
-8.75 |
-0.36 |
0 |
|
|
361736 |
127304552 |
1 |
SO3N4C19H30 |
AB3C4D19E30 |
-121.53 |
3.31 |
-8.86 |
0.11 |
0 |
|
|
361737 |
127304553 |
1 |
O2N4C21H26 |
A2B4C21D26 |
-36.82 |
8.53 |
-8.62 |
-0.31 |
0 |
|
|
361738 |
127304554 |
1 |
FO2N4C21H23 |
AB2C4D21E23 |
-64.77 |
3.34 |
-8.99 |
-1.34 |
0 |