List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
370492 |
127339030 |
2 |
O2N3C7H9 |
A2B3C7D9 |
-130.34 |
1.68 |
-9.29 |
-0.72 |
0 |
|
|
370493 |
127339031 |
1 |
SN3O4C17H23 |
AB3C4D17E23 |
-148.86 |
6.78 |
-9.56 |
-0.55 |
0 |
|
|
370494 |
127339032 |
1 |
SN3O4C16H21 |
AB3C4D16E21 |
-137.29 |
8.42 |
-9.68 |
-1.04 |
0 |
|
|
370495 |
127339033 |
2 |
ON2C11H15 |
AB2C11D15 |
-42.2 |
4.12 |
-8.79 |
0.08 |
0 |
|
|
370496 |
127339034 |
1 |
ClN3O3C19H20 |
AB3C3D19E20 |
-53.6 |
6.41 |
-9.52 |
-0.67 |
0 |
|
|
370497 |
127339035 |
1 |
ON5C19H27 |
AB5C19D27 |
9.6 |
2.46 |
-8.86 |
-0.28 |
0 |
|
|
370498 |
127339036 |
1 |
SN3O3C20H31 |
AB3C3D20E31 |
-115.78 |
7.38 |
-8.95 |
-0.3 |
0 |
|
|
370499 |
127339037 |
1 |
O2N3C14H25 |
A2B3C14D25 |
-107.67 |
7.47 |
-9.09 |
0.85 |
0 |
|
|
370500 |
127339038 |
1 |
O3N4C20H28 |
A3B4C20D28 |
-117.81 |
3.45 |
-8.86 |
-0.39 |
0 |
|
|
370501 |
127339121 |
1 |
SO2N3C17H19 |
AB2C3D17E19 |
-21.62 |
6.75 |
-8.89 |
-0.77 |
0 |
|
|
370502 |
127339122 |
1 |
SN2O4C20H28 |
AB2C4D20E28 |
-166.68 |
3.12 |
-8.7 |
-0.43 |
0 |
|
|
370503 |
127339434 |
1 |
O3N4C20H26 |
A3B4C20D26 |
-123.7 |
4.03 |
-9.72 |
-1.3 |
0 |
|
|
370504 |
127339435 |
1 |
SN2O5C19H26 |
AB2C5D19E26 |
-180.78 |
11.97 |
-9.17 |
-0.53 |
0 |
|
|
370505 |
127339438 |
1 |
N3O3C15H23 |
A3B3C15D23 |
-128.68 |
4.12 |
-9.77 |
-0.39 |
0 |
|
|
370506 |
127339439 |
1 |
ON3C16H23 |
AB3C16D23 |
-21.25 |
2.66 |
-8.87 |
-0.13 |
0 |
|
|
370507 |
127339448 |
1 |
O2N5C16H21 |
A2B5C16D21 |
-8.32 |
3.59 |
-8.79 |
-0.78 |
0 |
|
|
370508 |
127339449 |
1 |
N3O3C20H29 |
A3B3C20D29 |
-130.48 |
2.95 |
-8.96 |
-0.13 |
0 |
|
|
370509 |
127339450 |
2 |
ON2C10H13 |
AB2C10D13 |
-31.08 |
6.15 |
-8.61 |
-0.23 |
0 |
|
|
370510 |
127339451 |
1 |
N4O4C19H26 |
A4B4C19D26 |
-151.68 |
6.38 |
-8.77 |
-0.45 |
0 |
|
|
370511 |
127339452 |
1 |
N3O3C18H25 |
A3B3C18D25 |
-122.29 |
1.5 |
-8.95 |
-0.19 |
0 |
|
|
370512 |
127339479 |
1 |
NSO3C10H19 |
ABC3D10E19 |
-155.49 |
4.74 |
-9.99 |
0.57 |
0 |
|
|
370513 |
127339480 |
1 |
SN3O5C15H17 |
AB3C5D15E17 |
-189.79 |
7.48 |
-9.78 |
-1.19 |
0 |
|
|
370514 |
127339481 |
1 |
SN2O5C17H22 |
AB2C5D17E22 |
-171.98 |
7.63 |
-9.15 |
-0.39 |
0 |
|
|
370515 |
127339482 |
1 |
SO3N5C17H21 |
AB3C5D17E21 |
-48.69 |
4.39 |
-9.59 |
-1.3 |
0 |
|
|
370516 |
127339483 |
1 |
SN2O4C15H24 |
AB2C4D15E24 |
-189.46 |
2.09 |
-9.59 |
0.14 |
0 |
|
|
370517 |
127339491 |
1 |
SN3O4C19H31 |
AB3C4D19E31 |
-211.96 |
6.22 |
-9.72 |
0.45 |
0 |
|
|
370518 |
127339492 |
1 |
FN2S2O5C14H19 |
AB2C2D5E14F19 |
-234.44 |
2.11 |
-10.27 |
-0.97 |
0 |
|
|
370519 |
127339498 |
1 |
SN2O3C18H26 |
AB2C3D18E26 |
-95.09 |
6.45 |
-9.22 |
-0.33 |
0 |
|
|
370520 |
127339499 |
1 |
NSO5C14H25 |
ABC5D14E25 |
-236.86 |
2.93 |
-10.01 |
0.31 |
0 |
|
|
370521 |
127339529 |
1 |
SN3O4C14H15 |
AB3C4D14E15 |
-68.17 |
6.86 |
-10.2 |
-1.52 |
0 |
|
|
370522 |
127339530 |
1 |
SN4O5C15H18 |
AB4C5D15E18 |
-177.27 |
2.78 |
-10.04 |
-1.68 |
0 |
|
|
370523 |
127339531 |
1 |
NS2O3C12H17 |
AB2C3D12E17 |
-120.54 |
6.23 |
-9.38 |
-0.68 |
0 |
|
|
370524 |
127339532 |
1 |
SN3O4C18H27 |
AB3C4D18E27 |
-171.53 |
6.49 |
-9.83 |
-0.26 |
0 |
|
|
370525 |
127339538 |
1 |
NSO3C14H25 |
ABC3D14E25 |
-167.59 |
4.86 |
-10.01 |
0.58 |
0 |
|
|
370526 |
127339539 |
1 |
NSO3C9H17 |
ABC3D9E17 |
-150.66 |
4.9 |
-10.07 |
0.53 |
0 |
|
|
370527 |
127339540 |
1 |
NS2O3C11H15 |
AB2C3D11E15 |
-110.5 |
5.93 |
-9.38 |
-0.92 |
0 |
|
|
370528 |
127339541 |
1 |
SN4O4C14H18 |
AB4C4D14E18 |
-111.82 |
6.08 |
-8.96 |
-0.98 |
0 |
|
|
370529 |
127339542 |
1 |
NSO3C15H19 |
ABC3D15E19 |
-115.42 |
5.13 |
-9.5 |
-0.06 |
0 |
|
|
370530 |
127339543 |
1 |
NSO4C14H17 |
ABC4D14E17 |
-143.44 |
3.02 |
-9.77 |
-0.72 |
0 |
|
|
370531 |
127339544 |
1 |
SN3O4C14H25 |
AB3C4D14E25 |
-202.2 |
6.52 |
-9.97 |
0.19 |
0 |
|
|
370532 |
127339545 |
1 |
S2N3O5C13H19 |
A2B3C5D13E19 |
-169.81 |
3.22 |
-10.2 |
-1.48 |
0 |
|
|
370533 |
127339546 |
1 |
SN2O3C11H16 |
AB2C3D11E16 |
-114.7 |
6.24 |
-9.41 |
0.19 |
0 |
|
|
370534 |
127339547 |
1 |
NS2O5C13H23 |
AB2C5D13E23 |
-233.38 |
6.5 |
-10.21 |
0.38 |
0 |
|
|
370535 |
127339548 |
1 |
N2S2O4C13H20 |
A2B2C4D13E20 |
-187.1 |
5.62 |
-9.27 |
-0.22 |
0 |
|
|
370536 |
127339549 |
1 |
SN3O4C16H21 |
AB3C4D16E21 |
-150.39 |
5.52 |
-9.57 |
-1.14 |
0 |
|
|
370537 |
127339550 |
1 |
SN2O4C15H16 |
AB2C4D15E16 |
-134.85 |
4.68 |
-9.34 |
-1.09 |
0 |
|
|
370538 |
127339551 |
1 |
F2N2S2O5C14H18 |
A2B2C2D5E14F18 |
-276.29 |
0.84 |
-10.32 |
-1.26 |
0 |
|
|
370539 |
127339559 |
1 |
NSO3C15H19 |
ABC3D15E19 |
-117.75 |
5.67 |
-9.6 |
-0.37 |
0 |
|
|
370540 |
127339560 |
1 |
S2O3N5C10H17 |
A2B3C5D10E17 |
-62.38 |
5.25 |
-8.93 |
-0.35 |
0 |
|
|
370541 |
127339561 |
1 |
SN3O5C12H17 |
AB3C5D12E17 |
-203.67 |
3.39 |
-10.13 |
-0.8 |
0 |
|
|
370542 |
127339562 |
1 |
NSO5C13H23 |
ABC5D13E23 |
-230.11 |
5.4 |
-9.87 |
0.41 |
0 |
|
|
370543 |
127339563 |
1 |
SN2O4C20H28 |
AB2C4D20E28 |
-170.0 |
2.83 |
-9.45 |
0.25 |
0 |
|
|
370544 |
127339625 |
1 |
SN3O5C16H25 |
AB3C5D16E25 |
-236.08 |
5.64 |
-10.2 |
-0.04 |
0 |
|
|
370545 |
127339626 |
1 |
NS2O3C8H15 |
AB2C3D8E15 |
-136.7 |
4.21 |
-9.09 |
-0.14 |
0 |
|
|
370546 |
127339627 |
1 |
NSO3C10H19 |
ABC3D10E19 |
-156.1 |
4.73 |
-10.01 |
0.57 |
0 |
|
|
370547 |
127339628 |
1 |
NSO3C12H21 |
ABC3D12E21 |
-155.53 |
4.99 |
-10.03 |
0.56 |
0 |
|
|
370548 |
127339629 |
1 |
NSO3C14H19 |
ABC3D14E19 |
-125.04 |
5.44 |
-9.51 |
-0.33 |
0 |
|
|
370549 |
127339630 |
1 |
O3N4C22H28 |
A3B4C22D28 |
-83.72 |
1.38 |
-9.46 |
-0.35 |
0 |
|
|
370550 |
127339631 |
1 |
SO3N5H17C19 |
AB3C5D17E19 |
-14.44 |
8.66 |
-9.59 |
-1.29 |
0 |
|
|
370551 |
127339686 |
1 |
SN4O4C18H24 |
AB4C4D18E24 |
-96.53 |
7.17 |
-9.36 |
-0.88 |
0 |
|
|
370552 |
127339687 |
1 |
O3N5C20H25 |
A3B5C20D25 |
-43.19 |
4.8 |
-8.56 |
-1.02 |
0 |
|
|
370553 |
127339688 |
1 |
O3N4C17H20 |
A3B4C17D20 |
-44.75 |
2.48 |
-9.73 |
-0.59 |
0 |
|
|
370554 |
127339689 |
1 |
OSN5C18H27 |
ABC5D18E27 |
1.88 |
3.11 |
-8.23 |
0.28 |
0 |
|
|
370555 |
127339690 |
1 |
O2N3C21H25 |
A2B3C21D25 |
-25.32 |
2.35 |
-8.7 |
-0.49 |
0 |
|
|
370556 |
127339691 |
1 |
O2N4C19H30 |
A2B4C19D30 |
-85.01 |
3.21 |
-9.25 |
0.65 |
0 |
|
|
370557 |
127339692 |
1 |
OF3N5C18H24 |
AB3C5D18E24 |
-143.51 |
6.17 |
-9.26 |
-0.4 |
0 |
|
|
370558 |
127339693 |
1 |
SO3N4C15H24 |
AB3C4D15E24 |
-96.05 |
5.91 |
-9.46 |
0.57 |
0 |
|
|
370559 |
127339694 |
1 |
O2N5C20H23 |
A2B5C20D23 |
-17.01 |
2.36 |
-9.03 |
-0.74 |
0 |
|
|
370560 |
127339695 |
1 |
OSN5C16H19 |
ABC5D16E19 |
47.28 |
1.66 |
-8.92 |
-0.65 |
0 |
|
|
370561 |
127339696 |
1 |
ON4C23H28 |
AB4C23D28 |
7.11 |
8.15 |
-8.33 |
-0.02 |
0 |
|
|
370562 |
127339697 |
2 |
ON3C10H14 |
AB3C10D14 |
-18.63 |
8.61 |
-9.08 |
0.45 |
0 |
|
|
370563 |
127339698 |
1 |
ON4C12H20 |
AB4C12D20 |
-11.04 |
2.08 |
-9.08 |
0.7 |
0 |
|
|
370564 |
127339699 |
2 |
ON2C8H10 |
AB2C8D10 |
-31.01 |
2.92 |
-9.22 |
-0.57 |
0 |
|
|
370565 |
127339700 |
1 |
OCl2N4C18H18 |
AB2C4D18E18 |
17.61 |
4.59 |
-8.95 |
-0.86 |
0 |
|
|
370566 |
127339701 |
1 |
ON7C17H19 |
AB7C17D19 |
85.74 |
5.72 |
-9.43 |
-1.34 |
0 |
|
|
370567 |
127339702 |
1 |
ON4C22H26 |
AB4C22D26 |
24.12 |
3.55 |
-9.32 |
-0.82 |
0 |
|
|
370568 |
127339703 |
1 |
O2N4C21H26 |
A2B4C21D26 |
-7.35 |
6.27 |
-8.93 |
-0.15 |
0 |
|
|
370569 |
127339704 |
1 |
ON5C16H23 |
AB5C16D23 |
18.61 |
1.92 |
-9.15 |
0.64 |
0 |
|
|
370570 |
127339705 |
1 |
ON5C18H27 |
AB5C18D27 |
2.05 |
5.06 |
-8.95 |
0.73 |
0 |
|
|
370571 |
127339706 |
1 |
ON4C22H28 |
AB4C22D28 |
8.99 |
2.46 |
-8.59 |
-0.27 |
0 |
|
|
370572 |
127339707 |
1 |
O2N5C20H33 |
A2B5C20D33 |
-75.22 |
9.3 |
-8.92 |
0.59 |
0 |
|
|
370573 |
127339708 |
1 |
ON5C17H19 |
AB5C17D19 |
51.35 |
4.52 |
-9.09 |
-0.76 |
0 |
|
|
370574 |
127339712 |
1 |
O2N4C21H28 |
A2B4C21D28 |
-26.3 |
2.59 |
-8.88 |
-0.04 |
0 |
|
|
370575 |
127339713 |
2 |
ON2C9H14 |
AB2C9D14 |
-78.63 |
0.43 |
-9.26 |
0.64 |
0 |
|
|
370576 |
127339714 |
1 |
ON3C16H25 |
AB3C16D25 |
-32.01 |
2.32 |
-9.06 |
0.74 |
0 |
|
|
370577 |
127339715 |
2 |
ON2C8H10 |
AB2C8D10 |
-35.21 |
4.86 |
-8.98 |
-0.64 |
0 |
|
|
370578 |
127339716 |
1 |
ON5C15H21 |
AB5C15D21 |
25.42 |
4.26 |
-9.07 |
0.63 |
0 |
|
|
370579 |
127339717 |
2 |
FON2C10H11 |
ABC2D10E11 |
-120.89 |
5.78 |
-9.04 |
-0.41 |
0 |
|
|
370580 |
127339718 |
1 |
ClFON4C18H18 |
ABCD4E18F18 |
-20.7 |
3.86 |
-8.89 |
-0.82 |
0 |
|
|
370581 |
127339719 |
1 |
ON5C17H25 |
AB5C17D25 |
13.91 |
4.41 |
-9.07 |
0.31 |
0 |
|
|
370582 |
127339720 |
1 |
ON6C14H20 |
AB6C14D20 |
44.16 |
2.1 |
-9.4 |
0.05 |
0 |
|
|
370583 |
127339721 |
1 |
ON6C16H18 |
AB6C16D18 |
73.15 |
3.29 |
-9.09 |
-1.21 |
0 |
|
|
370584 |
127339722 |
1 |
ON7C16H19 |
AB7C16D19 |
79.39 |
4.83 |
-9.21 |
-1.16 |
0 |
|
|
370585 |
127339723 |
1 |
ON5C17H21 |
AB5C17D21 |
51.5 |
4.65 |
-9.35 |
-0.8 |
0 |
|
|
370586 |
127339724 |
1 |
ON5C17H25 |
AB5C17D25 |
5.53 |
3.41 |
-9.15 |
0.64 |
0 |
|
|
370587 |
127339725 |
1 |
O2N5C20H27 |
A2B5C20D27 |
-34.45 |
2.21 |
-9.2 |
-0.85 |
0 |
|
|
370588 |
127339726 |
1 |
ON5C18H27 |
AB5C18D27 |
4.96 |
6.41 |
-9.01 |
0.76 |
0 |
|
|
370589 |
127339727 |
1 |
SO3N6C16H24 |
AB3C6D16E24 |
-59.1 |
10.02 |
-9.07 |
0.04 |
0 |
|
|
370590 |
127339728 |
1 |
ON5C15H21 |
AB5C15D21 |
25.7 |
2.59 |
-9.2 |
0.37 |
0 |
|
|
370591 |
127339729 |
1 |
ON4C20H22 |
AB4C20D22 |
32.0 |
7.28 |
-9.34 |
-0.81 |
0 |