List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
354685 |
127287384 |
1 |
O3N4C19H34 |
A3B4C19D34 |
-142.27 |
3.05 |
-8.67 |
0.93 |
0 |
|
|
354686 |
127287385 |
2 |
ON2C11H16 |
AB2C11D16 |
-65.33 |
4.41 |
-8.47 |
-0.02 |
0 |
|
|
354687 |
127287386 |
1 |
SO2N5C18H31 |
AB2C5D18E31 |
-69.47 |
3.07 |
-8.7 |
-0.25 |
0 |
|
|
354688 |
127287387 |
1 |
O3N5C18H33 |
A3B5C18D33 |
-124.04 |
3.04 |
-8.99 |
0.85 |
0 |
|
|
354689 |
127287388 |
1 |
N3O4C21H31 |
A3B4C21D31 |
-151.76 |
4.09 |
-8.52 |
0.3 |
0 |
|
|
354690 |
127287389 |
1 |
ClFN3O3C19H27 |
ABC3D3E19F27 |
-169.64 |
6.56 |
-9.05 |
-0.33 |
0 |
|
|
354691 |
127287390 |
1 |
F2N3O3C19H27 |
A2B3C3D19E27 |
-206.77 |
4.78 |
-9.05 |
-0.44 |
0 |
|
|
354692 |
127287391 |
1 |
N3O3C15H29 |
A3B3C15D29 |
-153.59 |
3.51 |
-8.61 |
1.11 |
0 |
|
|
354693 |
127287392 |
1 |
O3N5C18H31 |
A3B5C18D31 |
-94.25 |
2.82 |
-8.5 |
-0.29 |
0 |
|
|
354694 |
127287393 |
1 |
SO2N5C17H29 |
AB2C5D17E29 |
-57.86 |
5.36 |
-8.45 |
-0.52 |
0 |
|
|
354695 |
127287394 |
1 |
SO2N5C19H33 |
AB2C5D19E33 |
-73.41 |
2.92 |
-8.67 |
-0.32 |
0 |
|
|
354696 |
127287395 |
1 |
O2N4C23H32 |
A2B4C23D32 |
-55.8 |
4.47 |
-8.39 |
-0.06 |
0 |
|
|
354697 |
127287396 |
1 |
OSN5C20H35 |
ABC5D20E35 |
-42.31 |
2.33 |
-8.53 |
-0.47 |
0 |
|
|
354698 |
127287397 |
1 |
SO2N3C16H25 |
AB2C3D16E25 |
-57.8 |
2.08 |
-9.29 |
-0.53 |
0 |
|
|
354699 |
127287398 |
1 |
OS2N5C16H23 |
AB2C5D16E23 |
11.68 |
3.19 |
-8.84 |
-0.55 |
0 |
|
|
354700 |
127287399 |
1 |
O2N3C16H27 |
A2B3C16D27 |
-124.95 |
4.85 |
-9.43 |
1.12 |
0 |
|
|
354701 |
127287400 |
1 |
O2N3C12H21 |
A2B3C12D21 |
-114.65 |
6.46 |
-9.57 |
0.82 |
0 |
|
|
354702 |
127287401 |
1 |
ON5C21H25 |
AB5C21D25 |
23.16 |
4.09 |
-9.12 |
-1.2 |
0 |
|
|
354703 |
127287402 |
1 |
ON3C14H25 |
AB3C14D25 |
-48.65 |
3.7 |
-8.69 |
1.18 |
0 |
|
|
354704 |
127287403 |
1 |
O2N3C15H27 |
A2B3C15D27 |
-126.32 |
5.76 |
-9.4 |
1.15 |
0 |
|
|
354705 |
127287404 |
1 |
SN3O3C12H23 |
AB3C3D12E23 |
-153.04 |
3.76 |
-9.18 |
0.34 |
0 |
|
|
354706 |
127287405 |
1 |
ON3C13H25 |
AB3C13D25 |
-70.13 |
2.61 |
-8.77 |
1.23 |
0 |
|
|
354707 |
127287406 |
1 |
O2N3C14H25 |
A2B3C14D25 |
-120.17 |
5.55 |
-9.34 |
0.97 |
0 |
|
|
354708 |
127287407 |
2 |
ON2C9H16 |
AB2C9D16 |
-120.19 |
6.33 |
-8.86 |
0.94 |
0 |
|
|
354709 |
127287408 |
1 |
ON3C17H31 |
AB3C17D31 |
-86.21 |
4.13 |
-8.65 |
1.45 |
0 |
|
|
354710 |
127287409 |
1 |
ON3C12H23 |
AB3C12D23 |
-68.28 |
3.81 |
-8.65 |
1.2 |
0 |
|
|
354711 |
127287410 |
1 |
ON3C13H25 |
AB3C13D25 |
-70.78 |
3.26 |
-8.81 |
1.15 |
0 |
|
|
354712 |
127287411 |
1 |
ON3C15H29 |
AB3C15D29 |
-80.09 |
2.89 |
-8.65 |
1.27 |
0 |
|
|
354713 |
127287412 |
2 |
ON2C8H13 |
AB2C8D13 |
-65.93 |
3.16 |
-9.27 |
-0.09 |
0 |
|
|
354714 |
127287413 |
2 |
ON2C11H18 |
AB2C11D18 |
-95.09 |
5.22 |
-8.82 |
0.06 |
0 |
|
|
354715 |
127287414 |
1 |
O2N3C15H25 |
A2B3C15D25 |
-105.22 |
2.96 |
-9.38 |
1.08 |
0 |
|
|
354716 |
127287415 |
1 |
O2N4C17H32 |
A2B4C17D32 |
-120.4 |
5.24 |
-8.64 |
1.01 |
0 |
|
|
354717 |
127287416 |
1 |
SO2N3C14H25 |
AB2C3D14E25 |
-116.8 |
2.67 |
-8.8 |
0.49 |
0 |
|
|
354718 |
127287417 |
1 |
O2N5C21H39 |
A2B5C21D39 |
-121.56 |
4.11 |
-8.59 |
1.05 |
0 |
|
|
354719 |
127287418 |
2 |
ON2C8H14 |
AB2C8D14 |
-85.09 |
1.17 |
-8.92 |
0.92 |
0 |
|
|
354720 |
127287419 |
1 |
O3N4C21H36 |
A3B4C21D36 |
-175.1 |
3.87 |
-9.16 |
0.87 |
0 |
|
|
354721 |
127287420 |
1 |
O2N3C16H29 |
A2B3C16D29 |
-134.6 |
7.21 |
-9.2 |
1.19 |
0 |
|
|
354722 |
127287421 |
1 |
O2N6C17H26 |
A2B6C17D26 |
-49.34 |
8.34 |
-8.96 |
-0.52 |
0 |
|
|
354723 |
127287422 |
1 |
O2N3C14H25 |
A2B3C14D25 |
-120.21 |
2.8 |
-9.34 |
1.07 |
0 |
|
|
354724 |
127287423 |
1 |
SO2N3C14H25 |
AB2C3D14E25 |
-108.44 |
4.22 |
-8.8 |
0.44 |
0 |
|
|
354725 |
127287424 |
1 |
O2N3C16H29 |
A2B3C16D29 |
-128.61 |
2.76 |
-9.32 |
1.07 |
0 |
|
|
354726 |
127287425 |
2 |
N2O2C9H15 |
A2B2C9D15 |
-195.02 |
7.5 |
-9.27 |
0.64 |
0 |
|
|
354727 |
127287426 |
1 |
O2N3C15H27 |
A2B3C15D27 |
-126.03 |
4.36 |
-9.32 |
1.08 |
0 |
|
|
354728 |
127287427 |
1 |
O2N4C15H28 |
A2B4C15D28 |
-110.0 |
2.35 |
-8.7 |
1.01 |
0 |
|
|
354729 |
127287428 |
1 |
O3N5C18H29 |
A3B5C18D29 |
-90.72 |
4.29 |
-9.24 |
-0.01 |
0 |
|
|
354730 |
127287429 |
1 |
O2N6C17H26 |
A2B6C17D26 |
-62.32 |
6.55 |
-9.03 |
-0.39 |
0 |
|
|
354731 |
127287430 |
1 |
O2N3C15H27 |
A2B3C15D27 |
-126.76 |
2.35 |
-9.4 |
1.06 |
0 |
|
|
354732 |
127287431 |
1 |
O3N5C20H35 |
A3B5C20D35 |
-161.35 |
4.82 |
-9.05 |
0.75 |
0 |
|
|
354733 |
127287446 |
2 |
ON2C7H13 |
AB2C7D13 |
-108.36 |
1.47 |
-8.74 |
1.01 |
0 |
|
|
354734 |
127287447 |
3 |
NOC5H9 |
ABC5D9 |
-164.44 |
2.15 |
-9.26 |
0.92 |
0 |
|
|
354735 |
127287448 |
1 |
SO2N5C18H29 |
AB2C5D18E29 |
-67.43 |
6.43 |
-9.16 |
-0.53 |
0 |
|
|
354736 |
127287449 |
1 |
O3N5C19H31 |
A3B5C19D31 |
-109.99 |
7.76 |
-9.13 |
-0.33 |
0 |
|
|
354737 |
127287450 |
1 |
O2N4C17H32 |
A2B4C17D32 |
-120.61 |
6.4 |
-8.92 |
1.1 |
0 |
|
|
354738 |
127287484 |
1 |
SN3O4C18H25 |
AB3C4D18E25 |
-155.1 |
6.98 |
-9.29 |
-0.6 |
0 |
|
|
354739 |
127287499 |
1 |
SN2O2C11H20 |
AB2C2D11E20 |
-101.78 |
2.81 |
-8.88 |
0.07 |
0 |
|
|
354740 |
127287500 |
2 |
NOC7H12 |
ABC7D12 |
-111.64 |
6.06 |
-9.23 |
1.09 |
0 |
|
|
354741 |
127287501 |
1 |
SO2N3C21H29 |
AB2C3D21E29 |
-60.88 |
3.06 |
-8.87 |
0.09 |
0 |
|
|
354742 |
127287502 |
1 |
SO2N3C21H31 |
AB2C3D21E31 |
-84.87 |
3.46 |
-8.87 |
0.02 |
0 |
|
|
354743 |
127287503 |
1 |
O2N3C24H35 |
A2B3C24D35 |
-92.9 |
6.79 |
-9.13 |
0.18 |
0 |
|
|
354744 |
127287504 |
1 |
N2S2O5C16H28 |
A2B2C5D16E28 |
-212.27 |
3.19 |
-9.88 |
0.02 |
0 |
|
|
354745 |
127287505 |
1 |
SO2N3C19H33 |
AB2C3D19E33 |
-105.34 |
2.16 |
-8.71 |
-0.17 |
0 |
|
|
354746 |
127287506 |
1 |
SO2N3C19H35 |
AB2C3D19E35 |
-128.65 |
1.33 |
-8.61 |
-0.04 |
0 |
|
|
354747 |
127287507 |
1 |
O3N4C19H32 |
A3B4C19D32 |
-168.67 |
5.93 |
-8.55 |
0.04 |
0 |
|
|
354748 |
127287508 |
1 |
SO2N3C18H31 |
AB2C3D18E31 |
-100.0 |
6.74 |
-8.78 |
0.06 |
0 |
|
|
354749 |
127287509 |
1 |
SO2N3C18H33 |
AB2C3D18E33 |
-121.12 |
6.64 |
-8.65 |
0.12 |
0 |
|
|
354750 |
127287510 |
1 |
SO2N3C19H33 |
AB2C3D19E33 |
-116.2 |
6.31 |
-8.73 |
0.05 |
0 |
|
|
354751 |
127287511 |
1 |
O3N4C18H30 |
A3B4C18D30 |
-165.08 |
4.94 |
-8.63 |
-0.02 |
0 |
|
|
354752 |
127287512 |
1 |
SO3N4C18H30 |
AB3C4D18E30 |
-116.39 |
6.69 |
-8.69 |
-0.52 |
0 |
|
|
354753 |
127287513 |
1 |
SN3O4C19H23 |
AB3C4D19E23 |
-94.95 |
5.86 |
-8.74 |
-0.84 |
0 |
|
|
354754 |
127287514 |
1 |
ON6C22H30 |
AB6C22D30 |
16.42 |
4.55 |
-8.75 |
-0.23 |
0 |
|
|
354755 |
127287515 |
1 |
SN6C20H24 |
AB6C20D24 |
96.23 |
6.47 |
-8.84 |
-0.57 |
0 |
|
|
354756 |
127287516 |
1 |
SO3N4C19H32 |
AB3C4D19E32 |
-120.85 |
1.54 |
-8.5 |
-0.54 |
0 |
|
|
354757 |
127287517 |
1 |
ON6C22H30 |
AB6C22D30 |
10.89 |
4.72 |
-8.85 |
-0.21 |
0 |
|
|
354758 |
127287518 |
1 |
SO3N4C17H28 |
AB3C4D17E28 |
-111.35 |
4.56 |
-8.73 |
-0.68 |
0 |
|
|
354759 |
127287519 |
1 |
N5C18H25 |
A5B18C25 |
54.89 |
4.48 |
-8.81 |
-0.22 |
0 |
|
|
354760 |
127287520 |
1 |
OSN4C13H22 |
ABC4D13E22 |
-27.36 |
5.45 |
-9.25 |
-0.52 |
0 |
|
|
354761 |
127287521 |
1 |
SO2N5C18H31 |
AB2C5D18E31 |
-79.94 |
6.5 |
-8.91 |
-0.26 |
0 |
|
|
354762 |
127287522 |
1 |
SO2N5C15H27 |
AB2C5D15E27 |
-67.63 |
3.86 |
-9.12 |
-0.54 |
0 |
|
|
354763 |
127287523 |
1 |
OSN5C15H25 |
ABC5D15E25 |
-4.17 |
3.91 |
-9.13 |
-0.58 |
0 |
|
|
354764 |
127287524 |
1 |
SO2N5C14H25 |
AB2C5D14E25 |
-69.6 |
3.45 |
-8.7 |
-0.79 |
0 |
|
|
354765 |
127287525 |
1 |
O2N5C22H31 |
A2B5C22D31 |
-48.04 |
3.75 |
-8.85 |
-0.08 |
0 |
|
|
354766 |
127287526 |
1 |
O2N5C21H31 |
A2B5C21D31 |
-54.95 |
2.06 |
-8.06 |
0.01 |
0 |
|
|
354767 |
127287527 |
1 |
O3N4C20H28 |
A3B4C20D28 |
-90.03 |
3.22 |
-8.1 |
-0.04 |
0 |
|
|
354768 |
127287528 |
1 |
O3N5C17H21 |
A3B5C17D21 |
-71.21 |
5.3 |
-8.79 |
-0.51 |
0 |
|
|
354769 |
127287529 |
1 |
SN2O3C14H20 |
AB2C3D14E20 |
-129.46 |
5.64 |
-9.05 |
0.08 |
0 |
|
|
354770 |
127287530 |
1 |
O2N3C16H21 |
A2B3C16D21 |
-80.45 |
6.46 |
-8.7 |
0.18 |
0 |
|
|
354771 |
127287531 |
1 |
SN2O3C14H18 |
AB2C3D14E18 |
-115.76 |
4.91 |
-8.77 |
0.01 |
0 |
|
|
354772 |
127287532 |
1 |
SN3O4C15H19 |
AB3C4D15E19 |
-147.57 |
8.34 |
-8.41 |
-0.17 |
0 |
|
|
354773 |
127287533 |
1 |
SN3O4C15H19 |
AB3C4D15E19 |
-127.73 |
3.38 |
-9.41 |
-0.75 |
0 |
|
|
354774 |
127287534 |
1 |
SN3O4C16H21 |
AB3C4D16E21 |
-149.52 |
6.91 |
-9.3 |
-0.46 |
0 |
|
|
354775 |
127287535 |
1 |
N4O4C17H22 |
A4B4C17D22 |
-132.96 |
2.03 |
-9.35 |
-0.57 |
0 |
|
|
354776 |
127287536 |
1 |
SN3O4C15H19 |
AB3C4D15E19 |
-133.98 |
2.87 |
-8.94 |
-0.21 |
0 |
|
|
354777 |
127287537 |
1 |
SN3O4C16H21 |
AB3C4D16E21 |
-136.36 |
6.17 |
-9.38 |
-0.6 |
0 |
|
|
354778 |
127287538 |
1 |
SN3O4C16H21 |
AB3C4D16E21 |
-139.26 |
7.65 |
-8.8 |
-0.22 |
0 |
|
|
354779 |
127287539 |
1 |
ClSN3O4C15H18 |
ABC3D4E15F18 |
-136.4 |
5.21 |
-9.41 |
-0.9 |
0 |
|
|
354780 |
127287540 |
1 |
O3N4C17H24 |
A3B4C17D24 |
-91.13 |
4.88 |
-9.03 |
-0.25 |
0 |
|
|
354781 |
127287541 |
1 |
SN3O3C12H17 |
AB3C3D12E17 |
-102.42 |
6.41 |
-10.08 |
-0.4 |
0 |
|
|
354782 |
127287542 |
1 |
SN2O3C9H18 |
AB2C3D9E18 |
-151.94 |
6.2 |
-10.04 |
0.6 |
0 |
|
|
354783 |
127287543 |
1 |
O2N3C12H21 |
A2B3C12D21 |
-103.46 |
3.47 |
-9.07 |
0.65 |
0 |
|
|
354784 |
127287544 |
1 |
SO2N4C13H14 |
AB2C4D13E14 |
-29.02 |
4.86 |
-8.86 |
-0.63 |
0 |