List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
279550 |
103844304 |
1 |
O2N3C10H15 |
A2B3C10D15 |
-75.13 |
3.05 |
-8.59 |
-0.52 |
0 |
|
|
279551 |
103844305 |
1 |
O3N5C11H17 |
A3B5C11D17 |
-47.97 |
3.17 |
-9.64 |
-1.14 |
0 |
|
|
279552 |
103844306 |
1 |
O2N3C11H17 |
A2B3C11D17 |
-71.39 |
1.33 |
-9.05 |
-0.06 |
0 |
|
|
279553 |
103844307 |
1 |
ClN3O3C13H20 |
AB3C3D13E20 |
-120.93 |
5.26 |
-9.09 |
-0.77 |
0 |
|
|
279554 |
103844312 |
1 |
ON3C12H21 |
AB3C12D21 |
-43.2 |
3.22 |
-9.08 |
-0.06 |
0 |
|
|
279555 |
103844313 |
1 |
ON5C14H21 |
AB5C14D21 |
39.23 |
8.4 |
-9.53 |
-0.86 |
0 |
|
|
279556 |
103844317 |
1 |
BrN3O3C12H18 |
AB3C3D12E18 |
-50.06 |
9.83 |
-9.21 |
-1.1 |
0 |
|
|
279557 |
103844323 |
1 |
ON3C13H23 |
AB3C13D23 |
-51.82 |
2.51 |
-8.89 |
0.17 |
0 |
|
|
279558 |
103844324 |
1 |
O2N3C11H19 |
A2B3C11D19 |
-78.27 |
2.29 |
-8.49 |
-0.45 |
0 |
|
|
279559 |
103844326 |
1 |
ON3C13H23 |
AB3C13D23 |
-46.6 |
2.64 |
-9.11 |
-0.08 |
0 |
|
|
279560 |
103844336 |
1 |
OF2N2C14H18 |
AB2C2D14E18 |
-105.66 |
5.33 |
-9.03 |
-1.06 |
0 |
|
|
279561 |
103844341 |
1 |
O3N4C13H18 |
A3B4C13D18 |
-14.74 |
6.44 |
-9.86 |
-1.58 |
0 |
|
|
279562 |
103844343 |
1 |
N3O3C12H19 |
A3B3C12D19 |
-50.85 |
5.9 |
-9.61 |
-1.32 |
0 |
|
|
279563 |
103844344 |
1 |
N3O3C13H21 |
A3B3C13D21 |
-57.57 |
10.52 |
-8.88 |
-0.87 |
0 |
|
|
279564 |
103844349 |
1 |
ClON3C14H24 |
ABC3D14E24 |
-60.57 |
4.82 |
-9.0 |
-0.25 |
0 |
|
|
279565 |
103844351 |
1 |
ON2F3C13H19 |
AB2C3D13E19 |
-200.37 |
3.12 |
-9.09 |
-0.68 |
0 |
|
|
279566 |
103844353 |
1 |
ON2C16H22 |
AB2C16D22 |
-24.2 |
1.59 |
-8.57 |
-0.54 |
0 |
|
|
279567 |
103844354 |
1 |
F2N2O3C13H18 |
A2B2C3D13E18 |
-141.82 |
7.77 |
-9.2 |
-1.47 |
0 |
|
|
279568 |
103844359 |
1 |
ON4C14H22 |
AB4C14D22 |
-6.39 |
5.05 |
-8.64 |
-0.38 |
0 |
|
|
279569 |
103844360 |
1 |
N3O3C13H21 |
A3B3C13D21 |
-102.38 |
7.31 |
-8.9 |
-0.55 |
0 |
|
|
279570 |
103844363 |
1 |
O3N4C12H22 |
A3B4C12D22 |
-117.55 |
4.0 |
-8.77 |
-0.61 |
0 |
|
|
279571 |
103844365 |
1 |
OF3N3C12H18 |
AB3C3D12E18 |
-186.55 |
3.52 |
-9.42 |
-0.89 |
0 |
|
|
279572 |
103844367 |
1 |
N3O3C12H19 |
A3B3C12D19 |
-40.23 |
9.22 |
-9.1 |
-1.21 |
0 |
|
|
279573 |
103844368 |
1 |
ClON3C12H20 |
ABC3D12E20 |
-49.82 |
4.57 |
-9.35 |
-0.38 |
0 |
|
|
279574 |
103844371 |
1 |
OSN2C12H22 |
ABC2D12E22 |
-50.4 |
2.21 |
-8.64 |
-0.13 |
0 |
|
|
279575 |
103844373 |
1 |
N3O3C13H21 |
A3B3C13D21 |
-60.74 |
7.21 |
-9.37 |
-1.01 |
0 |
|
|
279576 |
103844379 |
1 |
O2N3C15H25 |
A2B3C15D25 |
-89.91 |
2.98 |
-9.01 |
-0.47 |
0 |
|
|
279577 |
103844382 |
1 |
ClON3C11H18 |
ABC3D11E18 |
-33.4 |
3.51 |
-9.1 |
-0.7 |
0 |
|
|
279578 |
103844384 |
1 |
O2N3C12H21 |
A2B3C12D21 |
-78.72 |
2.97 |
-8.34 |
-0.33 |
0 |
|
|
279579 |
103844386 |
1 |
BrN3O3C12H18 |
AB3C3D12E18 |
-46.18 |
3.94 |
-9.4 |
-1.51 |
0 |
|
|
279580 |
103844387 |
1 |
ON3C17H21 |
AB3C17D21 |
11.45 |
3.37 |
-8.89 |
-1.26 |
0 |
|
|
279581 |
103844388 |
1 |
N3O4C14H21 |
A3B4C14D21 |
-102.91 |
5.02 |
-9.33 |
-1.24 |
0 |
|
|
279582 |
103844389 |
1 |
ClON2F3C13H18 |
ABC2D3E13F18 |
-211.48 |
4.74 |
-9.18 |
-0.8 |
0 |
|
|
279583 |
103844390 |
1 |
O3N4C12H22 |
A3B4C12D22 |
-103.38 |
4.5 |
-9.54 |
-0.01 |
0 |
|
|
279584 |
103844391 |
1 |
ON4C14H22 |
AB4C14D22 |
-4.84 |
1.88 |
-8.88 |
-0.91 |
0 |
|
|
279585 |
103844392 |
1 |
ClON2C12H19 |
ABC2D12E19 |
-48.39 |
2.51 |
-8.69 |
-0.23 |
0 |
|
|
279586 |
103844394 |
1 |
N2O3C14H22 |
A2B3C14D22 |
-119.78 |
4.09 |
-9.17 |
-0.48 |
0 |
|
|
279587 |
103844396 |
1 |
O2N3C12H21 |
A2B3C12D21 |
-74.3 |
2.61 |
-9.03 |
-0.04 |
0 |
|
|
279588 |
103844399 |
1 |
ON4C14H20 |
AB4C14D20 |
6.29 |
2.38 |
-8.85 |
-1.03 |
0 |
|
|
279589 |
103844402 |
1 |
O3N4C12H22 |
A3B4C12D22 |
-49.05 |
5.62 |
-9.29 |
-0.68 |
0 |
|
|
279590 |
103844406 |
1 |
OSN2C14H20 |
ABC2D14E20 |
-22.58 |
2.4 |
-8.46 |
-0.54 |
0 |
|
|
279591 |
103844407 |
1 |
OSN3C12H23 |
ABC3D12E23 |
-42.73 |
2.47 |
-9.08 |
-0.46 |
0 |
|
|
279592 |
103844416 |
1 |
ON3C14H23 |
AB3C14D23 |
-42.36 |
2.73 |
-8.97 |
-0.09 |
0 |
|
|
279593 |
103844419 |
1 |
N2O3C14H22 |
A2B3C14D22 |
-62.28 |
5.83 |
-8.83 |
-1.09 |
0 |
|
|
279594 |
103844420 |
1 |
ClO2N3C12H20 |
AB2C3D12E20 |
-80.97 |
5.1 |
-8.96 |
-0.62 |
0 |
|
|
279595 |
103844425 |
1 |
ON3C16H27 |
AB3C16D27 |
-54.75 |
2.65 |
-8.9 |
0.0 |
0 |
|
|
279596 |
103844433 |
1 |
ON3C13H19 |
AB3C13D19 |
-2.69 |
7.78 |
-9.02 |
-0.77 |
0 |
|
|
279597 |
103844434 |
1 |
O3N4C12H22 |
A3B4C12D22 |
-146.71 |
4.17 |
-9.22 |
-0.42 |
0 |
|
|
279598 |
103844435 |
1 |
OSN3C13H19 |
ABC3D13E19 |
-11.63 |
3.25 |
-8.65 |
-0.81 |
0 |
|
|
279599 |
103844436 |
1 |
BrO2N3C12H20 |
AB2C3D12E20 |
-75.08 |
5.35 |
-9.15 |
-0.66 |
0 |
|
|
279600 |
103844437 |
1 |
ON2C17H24 |
AB2C17D24 |
-30.41 |
3.7 |
-8.43 |
-0.42 |
0 |
|
|
279601 |
103844438 |
1 |
FON3C11H18 |
ABC3D11E18 |
-71.91 |
2.99 |
-9.08 |
-0.51 |
0 |
|
|
279602 |
103844440 |
1 |
ON5C9H19 |
AB5C9D19 |
10.22 |
7.49 |
-9.63 |
-0.12 |
0 |
|
|
279603 |
103844441 |
1 |
O3N4C14H26 |
A3B4C14D26 |
-149.5 |
6.34 |
-8.85 |
-0.4 |
0 |
|
|
279604 |
103844443 |
1 |
ON4C11H20 |
AB4C11D20 |
-25.13 |
1.47 |
-8.69 |
-0.38 |
0 |
|
|
279605 |
103844446 |
1 |
O3N4C11H20 |
A3B4C11D20 |
-38.22 |
7.8 |
-9.19 |
-0.57 |
0 |
|
|
279606 |
103844447 |
1 |
BrON2C12H19 |
ABC2D12E19 |
-34.0 |
4.26 |
-8.88 |
-0.44 |
0 |
|
|
279607 |
103844451 |
1 |
BrNOC10H12 |
ABCD10E12 |
-11.15 |
5.4 |
-9.15 |
-0.48 |
0 |
|
|
279608 |
103844454 |
1 |
N2O3C14H18 |
A2B3C14D18 |
-55.17 |
3.95 |
-8.91 |
-0.53 |
0 |
|
|
279609 |
103844455 |
2 |
OC9H11 |
AB9C11 |
-72.85 |
2.45 |
-8.68 |
0.16 |
0 |
|
|
279610 |
103844456 |
1 |
NO3C12H13 |
AB3C12D13 |
-42.3 |
3.09 |
-9.11 |
-0.3 |
0 |
|
|
279611 |
103844461 |
1 |
ClNO4H14C15 |
ABC4D14E15 |
-54.51 |
5.51 |
-9.14 |
-1.59 |
0 |
|
|
279612 |
103844462 |
1 |
NO3C15H21 |
AB3C15D21 |
-96.64 |
4.76 |
-9.08 |
-0.17 |
0 |
|
|
279613 |
103844463 |
1 |
ClNO3C16H16 |
ABC3D16E16 |
-94.93 |
2.91 |
-9.25 |
-0.43 |
0 |
|
|
279614 |
103844467 |
1 |
FNO4H14C15 |
ABC4D14E15 |
-97.33 |
3.81 |
-9.09 |
-1.72 |
0 |
|
|
279615 |
103844468 |
1 |
ClFO2H14C15 |
ABC2D14E15 |
-101.83 |
1.25 |
-9.0 |
-0.61 |
0 |
|
|
279616 |
103844469 |
1 |
O2C13H20 |
A2B13C20 |
-93.59 |
3.47 |
-8.73 |
0.14 |
0 |
|
|
279617 |
103844472 |
1 |
O3C13H20 |
A3B13C20 |
-125.46 |
4.63 |
-8.67 |
0.2 |
0 |
|
|
279618 |
103844474 |
1 |
SO4C12H18 |
AB4C12D18 |
-162.85 |
7.66 |
-8.87 |
0.02 |
0 |
|
|
279619 |
103844476 |
1 |
NO3C15H23 |
AB3C15D23 |
-137.35 |
4.0 |
-9.12 |
-0.18 |
0 |
|
|
279620 |
103844477 |
1 |
NO3C13H19 |
AB3C13D19 |
-124.29 |
1.93 |
-9.13 |
-0.18 |
0 |
|
|
279621 |
103844484 |
2 |
NOC8H8 |
ABC8D8 |
-10.54 |
4.81 |
-8.83 |
-0.69 |
0 |
|
|
279622 |
103844490 |
1 |
O2F3H15C16 |
A2B3C15D16 |
-207.37 |
2.93 |
-9.05 |
-0.74 |
0 |
|
|
279623 |
103844491 |
1 |
O2C17H20 |
A2B17C20 |
-64.21 |
2.81 |
-8.74 |
0.13 |
0 |
|
|
279624 |
103844493 |
1 |
F3O3C13H17 |
A3B3C13D17 |
-277.83 |
5.53 |
-8.78 |
0.12 |
0 |