List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
343484 |
127266657 |
1 |
N3O3C15H17 |
A3B3C15D17 |
-53.5 |
5.97 |
-8.7 |
-0.31 |
0 |
|
|
343485 |
127266658 |
1 |
O2N3C15H19 |
A2B3C15D19 |
-24.76 |
7.09 |
-9.69 |
-1.0 |
0 |
|
|
343486 |
127266659 |
1 |
O2F3N4H11C12 |
A2B3C4D11E12 |
-153.81 |
3.04 |
-10.02 |
-1.11 |
0 |
|
|
343487 |
127266660 |
1 |
O2N3C15H19 |
A2B3C15D19 |
-27.32 |
3.48 |
-9.6 |
-1.15 |
0 |
|
|
343488 |
127266661 |
1 |
N3O3C17H23 |
A3B3C17D23 |
-76.11 |
6.6 |
-9.66 |
-0.15 |
0 |
|
|
343489 |
127266662 |
1 |
F3O3N5H10C12 |
A3B3C5D10E12 |
-178.15 |
3.33 |
-10.27 |
-1.76 |
0 |
|
|
343490 |
127266663 |
1 |
ClO2N6C12H13 |
AB2C6D12E13 |
15.33 |
1.56 |
-9.95 |
-1.06 |
0 |
|
|
343491 |
127266664 |
1 |
O2S2N3C14H19 |
A2B2C3D14E19 |
-31.27 |
3.92 |
-9.3 |
-0.97 |
0 |
|
|
343492 |
127266665 |
1 |
NSO4C13H21 |
ABC4D13E21 |
-169.93 |
5.13 |
-9.63 |
-0.65 |
0 |
|
|
343493 |
127266666 |
1 |
SN2O5C14H22 |
AB2C5D14E22 |
-184.72 |
3.38 |
-9.93 |
-1.42 |
0 |
|
|
343494 |
127266667 |
1 |
FSN3O4C14H18 |
ABC3D4E14F18 |
-188.27 |
3.46 |
-9.36 |
-0.96 |
0 |
|
|
343495 |
127266668 |
1 |
ON4C13H18 |
AB4C13D18 |
29.37 |
5.16 |
-8.58 |
-0.12 |
0 |
|
|
343496 |
127266669 |
1 |
O4N5C16H21 |
A4B5C16D21 |
-143.66 |
7.41 |
-9.24 |
-0.74 |
0 |
|
|
343497 |
127266670 |
2 |
N2O2C8H9 |
A2B2C8D9 |
-114.97 |
2.48 |
-9.35 |
-1.36 |
0 |
|
|
343498 |
127266671 |
1 |
SO2N5C14H15 |
AB2C5D14E15 |
1.59 |
1.72 |
-9.39 |
-1.22 |
0 |
|
|
343499 |
127266672 |
1 |
O3N5C17H19 |
A3B5C17D19 |
-48.24 |
2.88 |
-9.57 |
-1.08 |
0 |
|
|
343500 |
127266673 |
1 |
F2O3N5C12H13 |
A2B3C5D12E13 |
-129.06 |
1.49 |
-9.75 |
-1.33 |
0 |
|
|
343501 |
127266674 |
1 |
O2N6C13H16 |
A2B6C13D16 |
80.21 |
3.88 |
-9.34 |
-1.17 |
0 |
|
|
343502 |
127266675 |
1 |
O3N4C14H22 |
A3B4C14D22 |
-52.09 |
6.86 |
-9.05 |
-0.92 |
0 |
|
|
343503 |
127266676 |
1 |
OSN5C10H13 |
ABC5D10E13 |
22.11 |
1.03 |
-9.33 |
-0.95 |
0 |
|
|
343504 |
127266677 |
1 |
OF3N7H12C13 |
AB3C7D12E13 |
-85.4 |
7.8 |
-9.75 |
-1.34 |
0 |
|
|
343505 |
127266678 |
1 |
O3N5C14H17 |
A3B5C14D17 |
-76.54 |
3.52 |
-9.32 |
-1.17 |
0 |
|
|
343506 |
127266679 |
1 |
OF3N4H11C12 |
AB3C4D11E12 |
-144.97 |
2.8 |
-9.53 |
-1.05 |
0 |
|
|
343507 |
127266680 |
1 |
O3N5C14H21 |
A3B5C14D21 |
-30.81 |
6.24 |
-8.96 |
-1.22 |
0 |
|
|
343508 |
127266681 |
1 |
ClO2N5C13H14 |
AB2C5D13E14 |
-24.24 |
2.7 |
-9.73 |
-1.14 |
0 |
|
|
343509 |
127266682 |
1 |
O2N5C16H17 |
A2B5C16D17 |
61.69 |
4.79 |
-9.04 |
-0.96 |
0 |
|
|
343510 |
127266683 |
1 |
O2F3N6C12H13 |
A2B3C6D12E13 |
-123.16 |
12.09 |
-9.52 |
-1.07 |
0 |
|
|
343511 |
127266684 |
2 |
ON3C6H8 |
AB3C6D8 |
50.68 |
6.42 |
-9.4 |
-1.21 |
0 |
|
|
343512 |
127266685 |
1 |
N7C16H19 |
A7B16C19 |
107.34 |
3.55 |
-9.26 |
-0.24 |
0 |
|
|
343513 |
127266686 |
1 |
O3N5C17H27 |
A3B5C17D27 |
-40.6 |
8.39 |
-9.1 |
-1.31 |
0 |
|
|
343514 |
127266687 |
1 |
ON5C19H31 |
AB5C19D31 |
-11.15 |
3.36 |
-9.0 |
-0.26 |
0 |
|
|
343515 |
127266688 |
1 |
SO3N5C14H17 |
AB3C5D14E17 |
-79.8 |
2.51 |
-9.51 |
-1.46 |
0 |
|
|
343516 |
127266689 |
1 |
O3N6C10H12 |
A3B6C10D12 |
9.77 |
5.48 |
-9.54 |
-1.41 |
0 |
|
|
343517 |
127266690 |
1 |
FN3O3C15H22 |
AB3C3D15E22 |
-160.29 |
5.55 |
-8.95 |
-0.04 |
0 |
|
|
343518 |
127266691 |
1 |
FN3O4C14H18 |
AB3C4D14E18 |
-126.48 |
2.33 |
-9.17 |
-0.86 |
0 |
|
|
343519 |
127266692 |
1 |
OSN5C16H17 |
ABC5D16E17 |
54.14 |
2.97 |
-8.4 |
-0.82 |
0 |
|
|
343520 |
127266693 |
1 |
ON7C18H19 |
AB7C18D19 |
104.12 |
11.31 |
-8.67 |
-1.25 |
0 |
|
|
343521 |
127266694 |
1 |
O3N5C15H19 |
A3B5C15D19 |
-64.41 |
3.24 |
-9.5 |
-0.74 |
0 |
|
|
343522 |
127266695 |
1 |
OSN4C11H14 |
ABC4D11E14 |
20.11 |
5.61 |
-9.04 |
-0.77 |
0 |
|
|
343523 |
127266696 |
1 |
OF3N6H13C14 |
AB3C6D13E14 |
-87.78 |
10.84 |
-9.56 |
-1.2 |
0 |
|
|
343524 |
127266697 |
1 |
O3N4C15H18 |
A3B4C15D18 |
-78.44 |
2.49 |
-9.44 |
-0.8 |
0 |
|
|
343525 |
127266698 |
1 |
OF3N6H13C14 |
AB3C6D13E14 |
-100.53 |
10.04 |
-9.56 |
-1.16 |
0 |
|
|
343526 |
127266699 |
1 |
O4N5C16H21 |
A4B5C16D21 |
-92.63 |
4.88 |
-9.41 |
-0.85 |
0 |
|
|
343527 |
127266700 |
1 |
N7C19H21 |
A7B19C21 |
111.22 |
4.73 |
-8.75 |
-0.36 |
0 |
|
|
343528 |
127266701 |
1 |
ClN5C16H16 |
AB5C16D16 |
96.14 |
2.79 |
-8.74 |
-1.4 |
0 |
|
|
343529 |
127266702 |
1 |
ClN5C16H16 |
AB5C16D16 |
89.45 |
1.71 |
-8.81 |
-1.16 |
0 |
|
|
343530 |
127266703 |
1 |
O3N5C17H23 |
A3B5C17D23 |
-74.13 |
3.84 |
-9.39 |
-0.66 |
0 |
|
|
343531 |
127266704 |
1 |
SN3O4C16H19 |
AB3C4D16E19 |
-99.74 |
8.8 |
-8.03 |
-0.67 |
0 |
|
|
343532 |
127266705 |
1 |
SO2N4C15H22 |
AB2C4D15E22 |
-45.13 |
4.85 |
-9.26 |
-0.69 |
0 |
|
|
343533 |
127266706 |
1 |
SO3N4C13H16 |
AB3C4D13E16 |
-7.64 |
2.38 |
-9.47 |
-1.36 |
0 |
|
|
343534 |
127266707 |
1 |
SO3N4C14H18 |
AB3C4D14E18 |
-16.08 |
3.17 |
-9.34 |
-1.14 |
0 |
|
|
343535 |
127266708 |
1 |
O3N6C11H14 |
A3B6C11D14 |
4.19 |
5.1 |
-9.45 |
-1.25 |
0 |
|
|
343536 |
127266709 |
1 |
O2N5C16H19 |
A2B5C16D19 |
-37.9 |
3.34 |
-9.28 |
-0.74 |
0 |
|
|
343537 |
127266710 |
1 |
SF2N4H10C12 |
AB2C4D10E12 |
-1.24 |
4.57 |
-9.52 |
-1.4 |
0 |
|
|
343538 |
127266711 |
1 |
SF2N4H12C13 |
AB2C4D12E13 |
-6.42 |
4.01 |
-9.44 |
-1.52 |
0 |
|
|
343539 |
127266712 |
1 |
O2N7C14H19 |
A2B7C14D19 |
64.51 |
5.57 |
-9.36 |
-1.11 |
0 |
|
|
343540 |
127266713 |
1 |
F3N6C14H17 |
A3B6C14D17 |
-76.1 |
6.33 |
-9.22 |
-0.72 |
0 |
|
|
343541 |
127266714 |
1 |
O3N6C15H20 |
A3B6C15D20 |
-68.73 |
2.9 |
-9.6 |
-0.86 |
0 |
|
|
343542 |
127266715 |
1 |
ClO2N5C13H16 |
AB2C5D13E16 |
45.76 |
3.98 |
-9.18 |
-0.87 |
0 |
|
|
343543 |
127266716 |
1 |
O3N5C14H19 |
A3B5C14D19 |
-3.04 |
2.87 |
-9.37 |
-1.21 |
0 |
|
|
343544 |
127266717 |
1 |
ON6C18H22 |
AB6C18D22 |
50.61 |
4.8 |
-8.95 |
-0.53 |
0 |
|
|
343545 |
127266718 |
1 |
BrO3N4C12H15 |
AB3C4D12E15 |
-29.43 |
6.67 |
-9.21 |
-1.25 |
0 |
|
|
343546 |
127266719 |
1 |
O2N4C19H26 |
A2B4C19D26 |
-34.72 |
3.69 |
-8.76 |
-0.21 |
0 |
|
|
343547 |
127266720 |
1 |
O3N4C17H20 |
A3B4C17D20 |
4.11 |
5.31 |
-9.25 |
-1.22 |
0 |
|
|
343548 |
127266721 |
1 |
ON6C18H22 |
AB6C18D22 |
59.41 |
2.78 |
-8.51 |
-0.51 |
0 |
|
|
343549 |
127266722 |
1 |
ON6C18H20 |
AB6C18D20 |
89.71 |
6.39 |
-9.04 |
-1.11 |
0 |
|
|
343550 |
127266723 |
1 |
O3N5C13H15 |
A3B5C13D15 |
12.22 |
6.71 |
-9.36 |
-1.15 |
0 |
|
|
343551 |
127266724 |
1 |
O3N4C18H28 |
A3B4C18D28 |
-123.35 |
1.56 |
-9.0 |
-0.65 |
0 |
|
|
343552 |
127266725 |
1 |
SO3N4C16H20 |
AB3C4D16E20 |
-12.88 |
3.27 |
-9.17 |
-0.92 |
0 |
|
|
343553 |
127266726 |
1 |
O2N7C13H17 |
A2B7C13D17 |
65.43 |
0.83 |
-9.06 |
-0.83 |
0 |
|
|
343554 |
127266727 |
1 |
O2N7C15H21 |
A2B7C15D21 |
-21.44 |
3.33 |
-9.08 |
-0.58 |
0 |
|
|
343555 |
127266728 |
1 |
O2N7C13H17 |
A2B7C13D17 |
64.23 |
5.04 |
-8.95 |
-1.13 |
0 |
|
|
343556 |
127266729 |
1 |
O2N7C14H19 |
A2B7C14D19 |
64.12 |
5.27 |
-8.97 |
-0.7 |
0 |
|
|
343557 |
127266730 |
3 |
FNOC5H6 |
ABCD5E6 |
-273.61 |
5.9 |
-9.53 |
-1.48 |
0 |
|
|
343558 |
127266731 |
1 |
ON3C17H21 |
AB3C17D21 |
10.36 |
5.27 |
-8.49 |
-0.25 |
0 |