List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
432547 |
135172680 |
1 |
N7C25H33 |
A7B25C33 |
103.95 |
5.75 |
-8.06 |
-0.64 |
0 |
|
|
432548 |
135172681 |
3 |
F2O3C12H12 |
A2B3C12D12 |
-622.77 |
5.13 |
-8.9 |
-0.81 |
0 |
|
|
432549 |
135172682 |
2 |
N3C13H17 |
A3B13C17 |
86.91 |
5.26 |
-8.32 |
-0.26 |
0 |
|
|
432550 |
135172683 |
1 |
ClFN3O3H23C25 |
ABC3D3E23F25 |
-84.2 |
3.23 |
-9.1 |
-0.74 |
0 |
|
|
432551 |
135172684 |
1 |
N3O3C25H27 |
A3B3C25D27 |
-41.8 |
7.49 |
-8.86 |
-0.52 |
0 |
|
|
432552 |
135172685 |
2 |
ON2C13H15 |
AB2C13D15 |
-4.46 |
5.28 |
-8.8 |
-0.68 |
0 |
|
|
432553 |
135172686 |
1 |
O3N4H26C28 |
A3B4C26D28 |
-5.03 |
6.21 |
-8.88 |
-0.77 |
0 |
|
|
432554 |
135172687 |
1 |
O2N3C20H25 |
A2B3C20D25 |
-44.85 |
5.42 |
-9.05 |
-0.66 |
0 |
|
|
432555 |
135172688 |
1 |
O3N4C23H28 |
A3B4C23D28 |
-62.4 |
6.17 |
-9.04 |
-0.72 |
0 |
|
|
432556 |
135172689 |
1 |
O3N4C9H10 |
A3B4C9D10 |
-50.72 |
5.97 |
-9.74 |
-0.91 |
0 |
|
|
432557 |
135172690 |
1 |
O2N3C11H15 |
A2B3C11D15 |
-45.02 |
3.57 |
-9.17 |
-1.0 |
0 |
|
|
432558 |
135172691 |
1 |
F2O8C31H38 |
A2B8C31D38 |
-386.85 |
1.81 |
-9.18 |
-0.7 |
0 |
|
|
432559 |
135172692 |
1 |
ClO2N4C26H29 |
AB2C4D26E29 |
-15.85 |
4.97 |
-8.63 |
-0.74 |
0 |
|
|
432560 |
135172693 |
1 |
O3N4H30C31 |
A3B4C30D31 |
-10.67 |
8.55 |
-8.43 |
-0.68 |
0 |
|
|
432561 |
135172694 |
1 |
N5C11H19 |
A5B11C19 |
38.46 |
2.82 |
-8.66 |
-0.77 |
0 |
|
|
432562 |
135172695 |
1 |
ON4C12H18 |
AB4C12D18 |
0.23 |
2.82 |
-8.38 |
-1.29 |
0 |
|
|
432563 |
135172696 |
1 |
ClO2N3C11H12 |
AB2C3D11E12 |
-44.95 |
4.54 |
-9.88 |
-0.84 |
0 |
|
|
432564 |
135172697 |
1 |
FN3O3C26H28 |
AB3C3D26E28 |
-67.56 |
3.86 |
-8.46 |
-0.43 |
0 |
|
|
432565 |
135172698 |
1 |
O3N4C27H32 |
A3B4C27D32 |
-48.94 |
4.14 |
-8.43 |
-0.59 |
0 |
|
|
432566 |
135172699 |
1 |
O3N4H30C32 |
A3B4C30D32 |
4.26 |
5.12 |
-8.28 |
-0.74 |
0 |
|
|
432567 |
135172700 |
1 |
O3N4C32H34 |
A3B4C32D34 |
8.16 |
6.99 |
-8.29 |
-0.58 |
0 |
|
|
432568 |
135172701 |
1 |
SO3N7C28H29 |
AB3C7D28E29 |
-7.03 |
10.26 |
-8.06 |
-0.61 |
0 |
|
|
432569 |
135172702 |
1 |
O3N4C27H28 |
A3B4C27D28 |
-24.64 |
8.27 |
-8.47 |
-0.43 |
0 |
|
|
432570 |
135172703 |
1 |
O3N5C23H25 |
A3B5C23D25 |
-9.04 |
4.61 |
-8.98 |
-0.93 |
0 |
|
|
432571 |
135172704 |
1 |
O3N4C28H28 |
A3B4C28D28 |
-14.15 |
6.15 |
-8.91 |
-0.95 |
0 |
|
|
432572 |
135172705 |
4 |
NC2H4 |
AB2C4 |
29.87 |
2.72 |
-8.15 |
0.6 |
0 |
|
|
432573 |
135172706 |
1 |
O2N4C7H10 |
A2B4C7D10 |
-20.57 |
2.35 |
-9.01 |
-0.7 |
0 |
|
|
432574 |
135172707 |
1 |
N2C9H18 |
A2B9C18 |
15.83 |
2.1 |
-8.38 |
0.8 |
0 |
|
|
432575 |
135172708 |
1 |
O3N4C23H30 |
A3B4C23D30 |
-78.87 |
7.47 |
-8.93 |
-0.56 |
0 |
|
|
432576 |
135172709 |
1 |
O3N8C27H34 |
A3B8C27D34 |
-18.19 |
5.93 |
-8.68 |
-0.8 |
0 |
|
|
432577 |
135172710 |
1 |
O2F3N4C27H29 |
A2B3C4D27E29 |
-168.78 |
4.25 |
-8.82 |
-0.72 |
0 |
|
|
432578 |
135172712 |
1 |
O3N4C27H30 |
A3B4C27D30 |
-35.12 |
3.56 |
-8.42 |
-0.65 |
0 |
|
|
432579 |
135172713 |
1 |
FO2N4C26H27 |
AB2C4D26E27 |
-39.29 |
4.01 |
-8.59 |
-0.66 |
0 |
|
|
432580 |
135172714 |
1 |
FN4O6C25H37 |
AB4C6D25E37 |
-280.2 |
3.29 |
-9.14 |
-0.02 |
0 |
|
|
432581 |
135172715 |
1 |
ClFO2N4C26H28 |
ABC2D4E26F28 |
-62.14 |
6.84 |
-8.93 |
-0.56 |
0 |
|
|
432582 |
135172716 |
1 |
O3N5C23H23 |
A3B5C23D23 |
0.33 |
8.12 |
-9.21 |
-0.79 |
0 |
|
|
432583 |
135172717 |
1 |
N3O4C28H33 |
A3B4C28D33 |
-86.71 |
5.43 |
-9.12 |
-0.77 |
0 |
|
|
432584 |
135172718 |
2 |
NO3C13H18 |
AB3C13D18 |
-252.61 |
2.8 |
-9.14 |
-0.18 |
0 |
|
|
432585 |
135172719 |
1 |
FO2N4C26H29 |
AB2C4D26E29 |
-52.61 |
4.64 |
-8.65 |
-0.67 |
0 |
|
|
432586 |
135172720 |
1 |
N2O6C29H44 |
A2B6C29D44 |
-286.94 |
3.6 |
-9.29 |
0.22 |
0 |
|
|
432587 |
135172721 |
2 |
NO2C12H18 |
AB2C12D18 |
-173.17 |
3.73 |
-8.84 |
0.24 |
0 |
|
|
432588 |
135172722 |
1 |
N3C12H23 |
A3B12C23 |
13.91 |
4.06 |
-8.05 |
0.3 |
0 |
|
|
432589 |
135172723 |
1 |
FSN7O11C47H74 |
ABC7D11E47F74 |
-577.19 |
7.98 |
-8.79 |
-0.36 |
0 |
|
|
432590 |
135172724 |
2 |
NOC10H11 |
ABC10D11 |
-38.05 |
0.25 |
-9.55 |
0.07 |
0 |
|
|
432591 |
135172725 |
2 |
N2O2H12C13 |
A2B2C12D13 |
-30.35 |
2.34 |
-9.07 |
-0.71 |
0 |
|
|
432592 |
135172726 |
1 |
O2N4C27H30 |
A2B4C27D30 |
4.35 |
5.43 |
-8.61 |
-0.64 |
0 |
|
|
432593 |
135172727 |
1 |
N5O9C37H61 |
A5B9C37D61 |
-422.92 |
7.64 |
-8.93 |
0.06 |
0 |
|
|
432594 |
135172728 |
1 |
O4N6C29H36 |
A4B6C29D36 |
-126.81 |
0.62 |
-8.23 |
-0.07 |
0 |
|
|
432595 |
135172729 |
2 |
O4C17H23 |
A4B17C23 |
-338.53 |
4.04 |
-8.99 |
-0.68 |
0 |
|
|
432596 |
135172730 |
1 |
ON3C18H25 |
AB3C18D25 |
22.18 |
2.24 |
-8.41 |
0.07 |
0 |