List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
356485 |
127291591 |
1 |
ON5C20H33 |
AB5C20D33 |
-25.69 |
3.26 |
-8.6 |
0.93 |
0 |
|
|
356486 |
127291592 |
1 |
ON5C23H29 |
AB5C23D29 |
8.27 |
6.47 |
-8.37 |
0.01 |
0 |
|
|
356487 |
127291634 |
1 |
ON5C20H29 |
AB5C20D29 |
-8.61 |
6.38 |
-9.53 |
0.3 |
0 |
|
|
356488 |
127291635 |
1 |
ON5C13H19 |
AB5C13D19 |
39.75 |
5.55 |
-9.61 |
0.21 |
0 |
|
|
356489 |
127291636 |
1 |
O3N5C19H23 |
A3B5C19D23 |
-28.61 |
4.58 |
-8.42 |
-0.08 |
0 |
|
|
356490 |
127291637 |
1 |
ON5C20H25 |
AB5C20D25 |
37.15 |
6.7 |
-9.6 |
-0.13 |
0 |
|
|
356491 |
127291638 |
2 |
ON3C9H13 |
AB3C9D13 |
1.71 |
1.56 |
-9.46 |
0.24 |
0 |
|
|
356492 |
127291639 |
1 |
ON5C22H33 |
AB5C22D33 |
-6.75 |
4.56 |
-9.41 |
0.34 |
0 |
|
|
356493 |
127291640 |
1 |
O2N5C19H23 |
A2B5C19D23 |
8.99 |
2.78 |
-8.86 |
0.14 |
0 |
|
|
356494 |
127291641 |
2 |
N2C5H8 |
A2B5C8 |
59.5 |
6.62 |
-9.46 |
0.39 |
0 |
|
|
356495 |
127291642 |
1 |
FON5C16H18 |
ABC5D16E18 |
1.99 |
3.71 |
-9.19 |
-0.45 |
0 |
|
|
356496 |
127291643 |
1 |
O2N8C17H22 |
A2B8C17D22 |
21.15 |
4.99 |
-9.22 |
-0.7 |
0 |
|
|
356497 |
127291644 |
1 |
ON8C19H20 |
AB8C19D20 |
113.2 |
3.75 |
-9.46 |
-1.35 |
0 |
|
|
356498 |
127291645 |
1 |
OSN5C19H25 |
ABC5D19E25 |
43.28 |
7.88 |
-9.08 |
-0.17 |
0 |
|
|
356499 |
127291646 |
1 |
OSN8C17H18 |
ABC8D17E18 |
119.1 |
3.45 |
-9.38 |
-1.68 |
0 |
|
|
356500 |
127291647 |
1 |
N6C13H18 |
A6B13C18 |
97.07 |
6.78 |
-9.37 |
0.4 |
0 |
|
|
356501 |
127291648 |
1 |
N7C18H21 |
A7B18C21 |
142.82 |
10.77 |
-9.47 |
-0.37 |
0 |
|
|
356502 |
127291649 |
1 |
N7C16H23 |
A7B16C23 |
98.7 |
7.88 |
-9.44 |
0.2 |
0 |
|
|
356503 |
127291650 |
1 |
F3N6C14H17 |
A3B6C14D17 |
-61.21 |
4.56 |
-9.59 |
-0.1 |
0 |
|
|
356504 |
127291651 |
2 |
ON3C7H10 |
AB3C7D10 |
-5.34 |
4.63 |
-9.74 |
-0.31 |
0 |
|
|
356505 |
127291652 |
1 |
ON5C18H23 |
AB5C18D23 |
34.37 |
5.16 |
-9.17 |
0.04 |
0 |
|
|
356506 |
127291653 |
1 |
ON5C18H23 |
AB5C18D23 |
34.9 |
8.09 |
-8.82 |
0.06 |
0 |
|
|
356507 |
127291654 |
1 |
ON6C19H22 |
AB6C19D22 |
83.61 |
6.99 |
-9.06 |
-0.8 |
0 |
|
|
356508 |
127291655 |
2 |
ON3C7H10 |
AB3C7D10 |
-12.89 |
7.26 |
-9.62 |
0.2 |
0 |
|
|
356509 |
127291656 |
1 |
OF3N5C18H20 |
AB3C5D18E20 |
-112.25 |
7.05 |
-9.55 |
-0.83 |
0 |
|
|
356510 |
127291657 |
1 |
OF2N5C16H17 |
AB2C5D16E17 |
-47.89 |
3.05 |
-9.7 |
-0.76 |
0 |
|
|
356511 |
127291658 |
1 |
ON6C21H24 |
AB6C21D24 |
62.97 |
3.54 |
-8.46 |
-0.04 |
0 |
|
|
356512 |
127291659 |
1 |
O2N6C21H28 |
A2B6C21D28 |
12.82 |
10.17 |
-8.4 |
-0.05 |
0 |
|
|
356513 |
127291660 |
1 |
F2N6C13H16 |
A2B6C13D16 |
-0.39 |
4.74 |
-9.67 |
-0.18 |
0 |
|
|
356514 |
127291661 |
1 |
O3N5C17H19 |
A3B5C17D19 |
-14.22 |
4.67 |
-8.68 |
-0.46 |
0 |
|
|
356515 |
127291662 |
1 |
O2N5C19H23 |
A2B5C19D23 |
2.72 |
4.78 |
-9.14 |
-0.2 |
0 |
|
|
356516 |
127291663 |
1 |
FON5C17H20 |
ABC5D17E20 |
-2.25 |
7.73 |
-8.86 |
-0.14 |
0 |
|
|
356517 |
127291664 |
1 |
OSN5C17H21 |
ABC5D17E21 |
50.73 |
5.25 |
-9.22 |
-0.32 |
0 |
|
|
356518 |
127291665 |
1 |
SO2N6C16H18 |
AB2C6D16E18 |
33.76 |
7.84 |
-9.64 |
-0.94 |
0 |
|
|
356519 |
127291666 |
2 |
ON3C10H12 |
AB3C10D12 |
11.29 |
6.39 |
-9.08 |
-0.51 |
0 |
|
|
356520 |
127291667 |
1 |
ClFON5C17H19 |
ABCD5E17F19 |
-10.66 |
8.13 |
-9.17 |
-0.6 |
0 |
|
|
356521 |
127291668 |
1 |
ON5C22H35 |
AB5C22D35 |
-10.71 |
5.57 |
-9.4 |
0.41 |
0 |
|
|
356522 |
127291669 |
1 |
OSN5C20H25 |
ABC5D20E25 |
42.76 |
4.5 |
-8.82 |
-0.34 |
0 |
|
|
356523 |
127291670 |
1 |
FON5C16H18 |
ABC5D16E18 |
4.25 |
5.27 |
-9.25 |
-0.47 |
0 |
|
|
356524 |
127291671 |
1 |
ON6C17H28 |
AB6C17D28 |
7.19 |
6.58 |
-8.94 |
0.38 |
0 |
|
|
356525 |
127291672 |
1 |
ON5C20H27 |
AB5C20D27 |
29.02 |
5.13 |
-8.9 |
-0.05 |
0 |
|
|
356526 |
127291673 |
1 |
ClON5C17H20 |
ABC5D17E20 |
31.45 |
3.87 |
-9.06 |
-0.52 |
0 |
|
|
356527 |
127291674 |
1 |
OSN6C17H22 |
ABC6D17E22 |
50.18 |
8.05 |
-8.9 |
-0.41 |
0 |
|
|
356528 |
127291675 |
1 |
ON5C18H29 |
AB5C18D29 |
-4.39 |
6.31 |
-9.47 |
0.38 |
0 |
|
|
356529 |
127291676 |
1 |
N6C13H18 |
A6B13C18 |
109.5 |
4.92 |
-9.3 |
0.35 |
0 |
|
|
356530 |
127291677 |
2 |
N3C7H9 |
A3B7C9 |
102.45 |
7.17 |
-9.63 |
-0.5 |
0 |
|
|
356531 |
127291678 |
1 |
O2N5C18H23 |
A2B5C18D23 |
11.65 |
7.65 |
-8.95 |
-0.02 |
0 |
|
|
356532 |
127291712 |
1 |
SN3O3C20H31 |
AB3C3D20E31 |
-115.21 |
3.54 |
-8.89 |
0.62 |
0 |
|
|
356533 |
127291713 |
1 |
BrSO2N4C15H19 |
ABC2D4E15F19 |
-22.04 |
1.83 |
-9.14 |
-1.08 |
0 |
|
|
356534 |
127291714 |
1 |
N2O2C9H18 |
A2B2C9D18 |
-110.29 |
6.16 |
-9.03 |
1.32 |
0 |
|
|
356535 |
127291715 |
1 |
O2N4C17H28 |
A2B4C17D28 |
-85.68 |
3.59 |
-8.65 |
0.89 |
0 |
|
|
356536 |
127291716 |
1 |
ON4C23H32 |
AB4C23D32 |
-27.52 |
7.27 |
-8.49 |
0.18 |
0 |
|
|
356537 |
127291759 |
1 |
O3N5C19H21 |
A3B5C19D21 |
-46.67 |
5.04 |
-8.93 |
-1.4 |
0 |
|
|
356538 |
127291760 |
1 |
O4N5C17H23 |
A4B5C17D23 |
-135.9 |
1.9 |
-9.21 |
-0.54 |
0 |
|
|
356539 |
127291761 |
1 |
SN3O4C17H27 |
AB3C4D17E27 |
-159.32 |
4.32 |
-9.22 |
0.17 |
0 |
|
|
356540 |
127291762 |
1 |
N3O4C18H21 |
A3B4C18D21 |
-98.1 |
3.01 |
-8.98 |
-0.44 |
0 |
|
|
356541 |
127291763 |
1 |
O2F3N4C18H27 |
A2B3C4D18E27 |
-231.33 |
3.72 |
-9.09 |
0.17 |
0 |
|
|
356542 |
127291764 |
1 |
N3O3C22H27 |
A3B3C22D27 |
-74.71 |
4.0 |
-8.7 |
-0.54 |
0 |
|
|
356543 |
127291765 |
1 |
N3O4C19H31 |
A3B4C19D31 |
-166.62 |
3.11 |
-9.08 |
0.18 |
0 |
|
|
356544 |
127291766 |
1 |
O2N5C18H27 |
A2B5C18D27 |
-41.64 |
2.05 |
-8.87 |
0.33 |
0 |
|
|
356545 |
127291767 |
2 |
ON2C10H11 |
AB2C10D11 |
-4.01 |
4.54 |
-9.11 |
-0.98 |
0 |
|
|
356546 |
127291768 |
1 |
O3N4C21H34 |
A3B4C21D34 |
-142.66 |
1.62 |
-9.03 |
0.24 |
0 |
|
|
356547 |
127291769 |
1 |
O3N4C22H30 |
A3B4C22D30 |
-106.67 |
8.07 |
-8.8 |
0.06 |
0 |
|
|
356548 |
127291770 |
1 |
O2N5C18H21 |
A2B5C18D21 |
1.26 |
2.67 |
-9.08 |
-0.76 |
0 |
|
|
356549 |
127291771 |
1 |
N3O3C22H37 |
A3B3C22D37 |
-142.34 |
4.05 |
-8.8 |
0.24 |
0 |
|
|
356550 |
127291772 |
1 |
O3N5C18H27 |
A3B5C18D27 |
-62.28 |
4.65 |
-9.22 |
-0.18 |
0 |
|
|
356551 |
127291773 |
1 |
O2N5C20H31 |
A2B5C20D31 |
-53.63 |
3.86 |
-8.67 |
0.4 |
0 |
|
|
356552 |
127291774 |
1 |
O3N4C20H32 |
A3B4C20D32 |
-136.11 |
1.32 |
-9.02 |
0.24 |
0 |
|
|
356553 |
127291775 |
1 |
N3O3C23H31 |
A3B3C23D31 |
-90.19 |
3.23 |
-8.71 |
0.21 |
0 |
|
|
356554 |
127291776 |
1 |
O3N6C19H24 |
A3B6C19D24 |
-46.42 |
3.0 |
-8.94 |
-0.96 |
0 |
|
|
356555 |
127291777 |
1 |
O3N4C15H22 |
A3B4C15D22 |
-106.96 |
2.25 |
-9.21 |
0.15 |
0 |
|
|
356556 |
127291782 |
1 |
N3O4C18H29 |
A3B4C18D29 |
-161.87 |
2.76 |
-9.03 |
0.27 |
0 |
|
|
356557 |
127291783 |
1 |
O3N4C21H36 |
A3B4C21D36 |
-130.15 |
3.71 |
-8.75 |
0.34 |
0 |
|
|
356558 |
127291784 |
1 |
O2N5C18H25 |
A2B5C18D25 |
-4.15 |
4.11 |
-8.91 |
0.14 |
0 |
|
|
356559 |
127291785 |
1 |
SO2N5C19H29 |
AB2C5D19E29 |
-46.77 |
1.26 |
-8.24 |
0.18 |
0 |
|
|
356560 |
127291786 |
1 |
O3N4C19H30 |
A3B4C19D30 |
-129.01 |
4.9 |
-9.04 |
0.19 |
0 |
|
|
356561 |
127291787 |
1 |
SO2N4C19H28 |
AB2C4D19E28 |
-58.01 |
2.9 |
-9.04 |
-0.6 |
0 |
|
|
356562 |
127291788 |
1 |
O3N4C21H34 |
A3B4C21D34 |
-133.87 |
3.73 |
-9.09 |
0.34 |
0 |
|
|
356563 |
127291789 |
1 |
O2N6C21H28 |
A2B6C21D28 |
-5.47 |
2.42 |
-9.18 |
-0.66 |
0 |
|
|
356564 |
127291790 |
3 |
NOC7H9 |
ABC7D9 |
-58.36 |
3.23 |
-9.13 |
0.04 |
0 |
|
|
356565 |
127291791 |
1 |
SN3O3C18H29 |
AB3C3D18E29 |
-122.78 |
2.88 |
-8.81 |
0.14 |
0 |
|
|
356566 |
127291792 |
1 |
O3N5C20H25 |
A3B5C20D25 |
-22.63 |
6.89 |
-9.28 |
-1.08 |
0 |
|
|
356567 |
127291793 |
1 |
O3N5C16H23 |
A3B5C16D23 |
-50.61 |
4.84 |
-9.22 |
-0.24 |
0 |
|
|
356568 |
127291794 |
1 |
SO2N4C20H24 |
AB2C4D20E24 |
-25.69 |
5.42 |
-8.8 |
-0.96 |
0 |
|
|
356569 |
127291795 |
1 |
O2N7C20H27 |
A2B7C20D27 |
8.34 |
4.34 |
-8.54 |
-0.14 |
0 |
|
|
356570 |
127291796 |
1 |
O2N5C19H29 |
A2B5C19D29 |
-44.78 |
6.49 |
-8.62 |
0.4 |
0 |
|
|
356571 |
127291797 |
1 |
O3N4C17H22 |
A3B4C17D22 |
-90.12 |
6.47 |
-8.73 |
-0.66 |
0 |
|
|
356572 |
127291798 |
1 |
O2N5C18H27 |
A2B5C18D27 |
-39.5 |
4.89 |
-8.96 |
0.26 |
0 |
|
|
356573 |
127291799 |
1 |
SN4O4C18H30 |
AB4C4D18E30 |
-163.47 |
4.61 |
-8.68 |
0.26 |
0 |
|
|
356574 |
127291800 |
1 |
O3N4C20H32 |
A3B4C20D32 |
-133.94 |
5.04 |
-9.13 |
0.16 |
0 |
|
|
356575 |
127291801 |
1 |
O3N4C15H22 |
A3B4C15D22 |
-106.96 |
2.22 |
-9.2 |
0.16 |
0 |
|
|
356576 |
127291802 |
1 |
O4N6C19H22 |
A4B6C19D22 |
-109.71 |
5.17 |
-9.27 |
-1.37 |
0 |
|
|
356577 |
127291803 |
1 |
O2N4C23H28 |
A2B4C23D28 |
-37.77 |
3.76 |
-8.2 |
-0.28 |
0 |
|
|
356578 |
127291804 |
1 |
N3O3C17H27 |
A3B3C17D27 |
-118.93 |
1.71 |
-9.07 |
0.22 |
0 |
|
|
356579 |
127291805 |
1 |
N3O3C22H29 |
A3B3C22D29 |
-68.86 |
5.59 |
-8.64 |
0.2 |
0 |
|
|
356580 |
127291806 |
1 |
O3N4C22H24 |
A3B4C22D24 |
-5.47 |
3.51 |
-8.93 |
-0.68 |
0 |
|
|
356581 |
127291807 |
1 |
N3O3C19H23 |
A3B3C19D23 |
-64.21 |
4.61 |
-9.0 |
-0.81 |
0 |
|
|
356582 |
127291808 |
1 |
O3N4C21H26 |
A3B4C21D26 |
-69.54 |
8.4 |
-9.08 |
-0.89 |
0 |
|
|
356583 |
127291809 |
1 |
N3O3C20H25 |
A3B3C20D25 |
-74.77 |
4.43 |
-8.94 |
-0.77 |
0 |
|
|
356584 |
127291810 |
1 |
N3O3C20H25 |
A3B3C20D25 |
-72.69 |
2.94 |
-8.99 |
-0.7 |
0 |