List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
388567 |
134989523 |
1 |
NO2C14H17 |
AB2C14D17 |
-59.61 |
6.02 |
-9.69 |
-0.06 |
0 |
|
|
388568 |
134989524 |
2 |
OC8H8 |
AB8C8 |
-42.04 |
2.85 |
-8.85 |
-0.76 |
0 |
|
|
388569 |
134989528 |
1 |
ClNSO4H10C11 |
ABCD4E10F11 |
68.42 |
14.72 |
-9.15 |
-2.9 |
0 |
|
|
388570 |
134989531 |
1 |
N2C13H20 |
A2B13C20 |
36.1 |
1.41 |
-8.55 |
-0.12 |
0 |
|
|
388571 |
134989532 |
1 |
ON6H8C11 |
AB6C8D11 |
85.48 |
3.25 |
-10.33 |
-1.75 |
0 |
|
|
388572 |
134989533 |
1 |
IN2C11H13 |
AB2C11D13 |
50.11 |
11.05 |
-7.95 |
-1.05 |
1 |
|
|
388573 |
134989534 |
1 |
N2C11H13 |
A2B11C13 |
49.51 |
1.95 |
0.0 |
0.0 |
0 |
|
|
388574 |
134989535 |
1 |
N3C11H19 |
A3B11C19 |
26.08 |
2.52 |
-8.01 |
0.04 |
0 |
|
|
388575 |
134989537 |
1 |
ClO4C14H15 |
AB4C14D15 |
-160.14 |
2.83 |
-9.52 |
-0.73 |
0 |
|
|
388576 |
134989538 |
1 |
IO3C13H23 |
AB3C13D23 |
-153.75 |
4.03 |
-9.92 |
-1.08 |
0 |
|
|
388577 |
134989539 |
1 |
BrO3C10H15 |
AB3C10D15 |
-145.27 |
4.94 |
-10.39 |
-1.02 |
0 |
|
|
388578 |
134989540 |
2 |
O2C5H9 |
A2B5C9 |
-200.22 |
1.53 |
-9.8 |
0.34 |
0 |
|
|
388579 |
134989541 |
1 |
N3O3C12H23 |
A3B3C12D23 |
-100.24 |
4.41 |
-10.27 |
-0.37 |
0 |
|
|
388580 |
134989543 |
1 |
NO2C11H19 |
AB2C11D19 |
-98.64 |
5.48 |
-10.85 |
0.66 |
0 |
|
|
388581 |
134989546 |
2 |
N4C70H113 |
A4B70C113 |
-65.73 |
12.71 |
-7.9 |
-2.02 |
0 |
|
|
388582 |
134989549 |
1 |
O4N8H25F35C53 |
A4B8C25D35E53 |
-1557.28 |
4.68 |
-8.07 |
-2.18 |
0 |
|
|
388583 |
134989550 |
1 |
FeN8H40C72 |
AB8C40D72 |
585.79 |
0.81 |
-7.97 |
-1.94 |
0 |
|
|
388584 |
134989552 |
1 |
FeN8H56C64 |
AB8C56D64 |
432.92 |
6.88 |
-8.34 |
-1.89 |
0 |
|
|
388585 |
134989554 |
1 |
FeO2N10C114H154 |
AB2C10D114E154 |
235.38 |
13.95 |
-8.29 |
-1.64 |
0 |
|
|
388586 |
134989555 |
1 |
MgN8C96H96 |
AB8C96D96 |
685.95 |
15.5 |
-7.71 |
-2.54 |
0 |
|
|
388587 |
134989557 |
1 |
SiN2C13H14 |
AB2C13D14 |
59.09 |
5.5 |
-10.15 |
-0.85 |
0 |
|
|
388588 |
134989558 |
1 |
ClNO2C13H16 |
ABC2D13E16 |
-39.46 |
3.02 |
-9.91 |
-0.6 |
0 |
|
|
388589 |
134989564 |
1 |
NO4C13H17 |
AB4C13D17 |
-160.56 |
3.14 |
-9.74 |
0.01 |
0 |
|
|
388590 |
134989565 |
1 |
BNO2C12H17 |
ABC2D12E17 |
-83.77 |
1.25 |
0.0 |
0.0 |
0 |
|
|
388591 |
134989566 |
1 |
ClS2O4H5C7 |
AB2C4D5E7 |
58.61 |
10.1 |
-9.56 |
-3.6 |
0 |
|
|
388592 |
134989569 |
1 |
ON2H8C14 |
AB2C8D14 |
133.98 |
7.74 |
-10.21 |
-1.27 |
0 |
|
|
388593 |
134989571 |
1 |
NCl2H9C14 |
AB2C9D14 |
47.76 |
2.64 |
-8.57 |
-0.8 |
0 |
|
|
388594 |
134989573 |
2 |
COH2N3 |
ABC2D3 |
92.38 |
3.55 |
-9.41 |
-1.81 |
0 |
|
|
388595 |
134989578 |
2 |
FOC6H10 |
ABC6D10 |
-226.46 |
4.22 |
-10.48 |
0.86 |
0 |
|
|
388596 |
134989579 |
1 |
IO2C10H15 |
AB2C10D15 |
-73.61 |
4.56 |
-10.12 |
-1.28 |
0 |
|
|
388597 |
134989582 |
1 |
SiO3C11H18 |
AB3C11D18 |
-99.15 |
2.74 |
-10.2 |
0.32 |
0 |
|
|
388598 |
134989587 |
1 |
MnNa4S4N8H12O12C32 |
AB4C4D8E12F12G32 |
-312.28 |
28.21 |
0.0 |
0.0 |
0 |
|
|
388599 |
134989590 |
1 |
OVCl8H8N8C32 |
ABC8D8E8F32 |
310.39 |
3.21 |
0.0 |
0.0 |
0 |
|
|
388600 |
134989594 |
1 |
ZnO8N12H44C48 |
AB8C12D44E48 |
417.31 |
5.21 |
-7.62 |
-3.33 |
0 |
|
|
388601 |
134989596 |
1 |
CuS8N16O16C64H88 |
AB8C16D16E64F88 |
0.33 |
13.53 |
0.0 |
0.0 |
0 |
|
|
388602 |
134989601 |
1 |
FNSiC12H14 |
ABCD12E14 |
-23.32 |
2.59 |
-9.48 |
-0.38 |
0 |
|
|
388603 |
134989609 |
1 |
BrO3C7H11 |
AB3C7D11 |
-154.39 |
5.43 |
-10.77 |
-1.16 |
0 |
|
|
388605 |
134989612 |
1 |
NiO4N8C124H136 |
AB4C8D124E136 |
726.16 |
5.36 |
-7.28 |
-3.73 |
0 |
|
|
388606 |
134989621 |
1 |
ClSSeO4H7C11 |
ABCD4E7F11 |
74.66 |
14.12 |
-9.44 |
-3.26 |
0 |
|
|
388607 |
134989634 |
1 |
N3C7H7 |
A3B7C7 |
71.16 |
1.73 |
-11.02 |
0.11 |
0 |
|
|
388608 |
134989638 |
1 |
NF3O3C10H12 |
AB3C3D10E12 |
-280.67 |
4.99 |
-10.5 |
-0.8 |
0 |
|
|
388609 |
134989648 |
1 |
ON3C15H25 |
AB3C15D25 |
-29.15 |
6.86 |
-8.39 |
-0.06 |
0 |
|
|
388610 |
134989649 |
1 |
TeCl2C14H16 |
AB2C14D16 |
-11.65 |
3.46 |
-9.34 |
-1.62 |
0 |
|
|
388611 |
134989655 |
1 |
NO2C15H15 |
AB2C15D15 |
-23.21 |
0.55 |
-8.97 |
-0.14 |
0 |
|
|
388612 |
134989657 |
4 |
OC3H3 |
AB3C3 |
-129.67 |
4.22 |
-9.43 |
-0.62 |
0 |
|
|
388613 |
134989659 |
2 |
NH4O4C5 |
AB4C4D5 |
-145.44 |
6.63 |
-10.9 |
-2.18 |
0 |
|
|
388614 |
134989662 |
1 |
OSN4H8C12 |
ABC4D8E12 |
111.53 |
7.97 |
-9.03 |
-1.75 |
1 |
|
|
388615 |
134989665 |
1 |
ClOC9H12 |
ABC9D12 |
-49.21 |
1.36 |
0.0 |
0.0 |
0 |
|
|
388616 |
134989666 |
1 |
NO5H11C12 |
AB5C11D12 |
-132.02 |
7.9 |
-9.31 |
-1.62 |
0 |
|
|
388617 |
134989667 |
1 |
ClH4N5C6 |
AB4C5D6 |
129.29 |
5.01 |
-10.28 |
-1.83 |
0 |