List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
332356 |
127250642 |
1 |
O3N5C23H27 |
A3B5C23D27 |
-26.04 |
4.64 |
-7.91 |
-0.9 |
0 |
|
|
332357 |
127250643 |
1 |
O3N5C25H29 |
A3B5C25D29 |
-36.83 |
4.67 |
-8.17 |
-0.49 |
0 |
|
|
332358 |
127250644 |
1 |
O3N6C24H28 |
A3B6C24D28 |
-25.03 |
3.44 |
-8.8 |
-0.91 |
0 |
|
|
332359 |
127250645 |
1 |
O3N5C18H23 |
A3B5C18D23 |
-63.46 |
2.52 |
-9.01 |
-0.8 |
0 |
|
|
332360 |
127250646 |
1 |
O3N4C26H26 |
A3B4C26D26 |
-26.24 |
1.49 |
-8.67 |
-0.46 |
0 |
|
|
332361 |
127250647 |
1 |
O3N6C24H26 |
A3B6C24D26 |
-28.54 |
6.21 |
-8.98 |
-0.66 |
0 |
|
|
332362 |
127250648 |
1 |
O3N4C18H20 |
A3B4C18D20 |
-64.96 |
7.03 |
-9.44 |
-1.12 |
0 |
|
|
332363 |
127250649 |
1 |
O3N5C23H29 |
A3B5C23D29 |
-68.33 |
5.03 |
-9.43 |
-0.99 |
0 |
|
|
332364 |
127250650 |
1 |
O3N5C22H29 |
A3B5C22D29 |
-73.66 |
1.67 |
-9.09 |
-0.93 |
0 |
|
|
332365 |
127250651 |
1 |
O3N5C22H27 |
A3B5C22D27 |
-58.37 |
5.53 |
-9.34 |
-1.02 |
0 |
|
|
332366 |
127250652 |
1 |
O3N5C24H31 |
A3B5C24D31 |
-74.69 |
7.09 |
-9.04 |
-1.05 |
0 |
|
|
332367 |
127250653 |
1 |
SO3N6C21H22 |
AB3C6D21E22 |
-8.87 |
3.6 |
-9.54 |
-1.11 |
0 |
|
|
332368 |
127250654 |
2 |
ON3C11H12 |
AB3C11D12 |
6.54 |
3.98 |
-8.85 |
-1.08 |
0 |
|
|
332369 |
127250655 |
2 |
ON3C11H12 |
AB3C11D12 |
7.02 |
3.04 |
-8.93 |
-1.19 |
0 |
|
|
332370 |
127250656 |
1 |
O4N5C22H27 |
A4B5C22D27 |
-97.39 |
3.37 |
-9.16 |
-1.11 |
0 |
|
|
332371 |
127250657 |
1 |
SO3N5C22H23 |
AB3C5D22E23 |
-38.87 |
1.98 |
-9.37 |
-1.18 |
0 |
|
|
332372 |
127250658 |
1 |
O3N6C23H24 |
A3B6C23D24 |
-9.32 |
4.47 |
-9.23 |
-1.06 |
0 |
|
|
332373 |
127250659 |
1 |
O4N5C22H23 |
A4B5C22D23 |
-72.58 |
4.71 |
-9.43 |
-1.13 |
0 |
|
|
332374 |
127250660 |
1 |
N4O4C25H26 |
A4B4C25D26 |
-72.53 |
4.19 |
-9.27 |
-1.09 |
0 |
|
|
332375 |
127250661 |
1 |
FO3N4C25H25 |
AB3C4D25E25 |
-89.81 |
2.62 |
-9.28 |
-0.91 |
0 |
|
|
332376 |
127250662 |
1 |
O3N6C23H24 |
A3B6C23D24 |
-21.41 |
6.19 |
-9.0 |
-1.12 |
0 |
|
|
332377 |
127250663 |
2 |
N2O2C12H15 |
A2B2C12D15 |
-134.0 |
5.22 |
-9.7 |
-1.19 |
0 |
|
|
332378 |
127250664 |
1 |
O3N4C26H28 |
A3B4C26D28 |
-55.28 |
5.89 |
-9.11 |
-1.02 |
0 |
|
|
332379 |
127250665 |
1 |
N4O4C21H26 |
A4B4C21D26 |
-112.49 |
2.02 |
-9.34 |
-1.16 |
0 |
|
|
332380 |
127250666 |
1 |
O3N5C23H29 |
A3B5C23D29 |
-68.66 |
4.93 |
-8.88 |
-1.03 |
0 |
|
|
332381 |
127250667 |
1 |
O4N5C23H29 |
A4B5C23D29 |
-102.44 |
3.47 |
-9.11 |
-1.25 |
0 |
|
|
332382 |
127250668 |
1 |
FO3N5C24H24 |
AB3C5D24E24 |
-75.96 |
2.51 |
-9.15 |
-1.15 |
0 |
|
|
332383 |
127250669 |
2 |
ON3C11H12 |
AB3C11D12 |
8.87 |
3.31 |
-8.72 |
-1.05 |
0 |
|
|
332384 |
127250670 |
2 |
ON3C11H12 |
AB3C11D12 |
5.74 |
4.11 |
-9.01 |
-1.09 |
0 |
|
|
332385 |
127250671 |
1 |
O3N5C24H31 |
A3B5C24D31 |
-74.14 |
6.36 |
-9.07 |
-1.05 |
0 |
|
|
332386 |
127250672 |
1 |
O3N6C24H26 |
A3B6C24D26 |
-24.41 |
5.57 |
-9.15 |
-1.03 |
0 |
|
|
332387 |
127250673 |
1 |
O4N5C22H23 |
A4B5C22D23 |
-71.94 |
6.88 |
-9.44 |
-1.13 |
0 |
|
|
332388 |
127250674 |
1 |
O3N6C23H28 |
A3B6C23D28 |
-39.63 |
2.43 |
-8.64 |
-1.16 |
0 |
|
|
332389 |
127250675 |
1 |
N4O4C25H26 |
A4B4C25D26 |
-71.85 |
2.98 |
-9.29 |
-1.09 |
0 |
|
|
332390 |
127250676 |
1 |
O3N6C23H24 |
A3B6C23D24 |
-21.03 |
6.26 |
-8.77 |
-1.25 |
0 |
|
|
332391 |
127250677 |
1 |
O4N5C23H23 |
A4B5C23D23 |
-76.48 |
5.31 |
-9.24 |
-1.12 |
0 |
|
|
332392 |
127250678 |
1 |
O4N5C24H27 |
A4B5C24D27 |
-61.28 |
6.55 |
-9.55 |
-1.33 |
0 |
|
|
332393 |
127250679 |
2 |
N2O2C12H15 |
A2B2C12D15 |
-134.0 |
7.3 |
-9.63 |
-1.07 |
0 |
|
|
332394 |
127250680 |
1 |
O3N4C26H28 |
A3B4C26D28 |
-54.95 |
6.65 |
-9.07 |
-1.08 |
0 |
|
|
332395 |
127250681 |
1 |
N4O4C21H26 |
A4B4C21D26 |
-111.02 |
7.33 |
-9.26 |
-1.02 |
0 |
|
|
332396 |
127250682 |
2 |
ON2C10H10 |
AB2C10D10 |
19.78 |
2.4 |
-9.06 |
-0.35 |
0 |
|
|
332397 |
127250683 |
1 |
O3N4C23H26 |
A3B4C23D26 |
-33.5 |
4.0 |
-8.76 |
-0.36 |
0 |
|
|
332398 |
127250684 |
1 |
O2N6C23H24 |
A2B6C23D24 |
49.04 |
2.9 |
-8.79 |
-0.49 |
0 |
|
|
332399 |
127250685 |
2 |
ON3C10H12 |
AB3C10D12 |
22.17 |
5.22 |
-8.97 |
-0.46 |
0 |
|
|
332400 |
127250686 |
2 |
ON3C11H11 |
AB3C11D11 |
47.36 |
3.54 |
-8.75 |
-0.35 |
0 |
|
|
332401 |
127250687 |
1 |
O3N6C18H20 |
A3B6C18D20 |
30.4 |
5.46 |
-9.11 |
-0.57 |
0 |
|
|
332402 |
127250688 |
1 |
O2N5C23H33 |
A2B5C23D33 |
-27.01 |
4.13 |
-8.6 |
-0.28 |
0 |
|
|
332403 |
127250689 |
1 |
O3N4C21H28 |
A3B4C21D28 |
-85.83 |
3.27 |
-9.06 |
-0.49 |
0 |
|
|
332404 |
127250690 |
1 |
FO2N4C23H25 |
AB2C4D23E25 |
-47.27 |
2.63 |
-9.04 |
-0.38 |
0 |
|
|
332405 |
127250691 |
1 |
O2N5C24H27 |
A2B5C24D27 |
34.22 |
3.62 |
-7.86 |
-0.28 |
0 |
|
|
332406 |
127250692 |
1 |
O4N5C23H27 |
A4B5C23D27 |
-57.04 |
1.91 |
-8.84 |
-0.32 |
0 |
|
|
332407 |
127250693 |
1 |
ON6C21H26 |
AB6C21D26 |
74.56 |
7.03 |
-8.64 |
-0.15 |
0 |
|
|
332408 |
127250694 |
2 |
ON3C11H11 |
AB3C11D11 |
48.14 |
4.89 |
-8.89 |
-0.46 |
0 |
|
|
332409 |
127250695 |
1 |
SO4N5C17H23 |
AB4C5D17E23 |
-83.32 |
2.66 |
-9.14 |
-0.51 |
0 |
|
|
332410 |
127250696 |
1 |
FO2N4C21H21 |
AB2C4D21E21 |
-31.73 |
3.55 |
-8.9 |
-0.33 |
0 |
|
|
332411 |
127250697 |
1 |
ON6C23H26 |
AB6C23D26 |
74.22 |
3.79 |
-8.85 |
-0.32 |
0 |
|
|
332412 |
127250698 |
1 |
ON6C25H28 |
AB6C25D28 |
88.77 |
2.49 |
-8.83 |
-0.51 |
0 |
|
|
332413 |
127250699 |
1 |
ON6C20H26 |
AB6C20D26 |
59.86 |
4.52 |
-8.52 |
-0.31 |
0 |
|
|
332414 |
127250700 |
1 |
O3N5C24H29 |
A3B5C24D29 |
-20.9 |
4.1 |
-8.83 |
-0.16 |
0 |
|
|
332415 |
127250701 |
4 |
NOC6H7 |
ABC6D7 |
-72.34 |
2.87 |
-8.33 |
-0.4 |
0 |
|
|
332416 |
127250702 |
1 |
FSO3N4C20H21 |
ABC3D4E20F21 |
-72.15 |
7.46 |
-9.21 |
-0.57 |
0 |
|
|
332417 |
127250703 |
1 |
ON5C23H23 |
AB5C23D23 |
91.31 |
2.77 |
-8.82 |
-0.39 |
0 |
|
|
332418 |
127250704 |
2 |
ON2C12H14 |
AB2C12D14 |
-0.68 |
3.82 |
-8.53 |
-0.14 |
0 |
|
|
332419 |
127250705 |
1 |
FON5C24H26 |
ABC5D24E26 |
17.49 |
4.46 |
-8.49 |
-0.24 |
0 |
|
|
332420 |
127250706 |
1 |
ON6C23H26 |
AB6C23D26 |
71.22 |
5.52 |
-8.46 |
-0.34 |
0 |
|
|
332421 |
127250707 |
1 |
ON6C21H26 |
AB6C21D26 |
77.11 |
1.67 |
-8.11 |
-0.32 |
0 |
|
|
332422 |
127250708 |
1 |
SN4O4C22H26 |
AB4C4D22E26 |
-81.49 |
7.45 |
-8.8 |
-0.36 |
0 |
|
|
332423 |
127250709 |
1 |
O3N4C25H32 |
A3B4C25D32 |
-43.2 |
3.7 |
-8.57 |
-0.26 |
0 |
|
|
332424 |
127250710 |
1 |
OSN5C18H21 |
ABC5D18E21 |
60.34 |
3.88 |
-8.84 |
-0.35 |
0 |
|
|
332425 |
127250711 |
1 |
O3N5C24H29 |
A3B5C24D29 |
-27.82 |
4.02 |
-7.89 |
-0.29 |
0 |
|
|
332426 |
127250712 |
1 |
FO2N3C19H26 |
AB2C3D19E26 |
-81.3 |
1.27 |
-8.58 |
-0.34 |
0 |
|
|
332427 |
127250713 |
1 |
N3O3C20H29 |
A3B3C20D29 |
-79.0 |
2.68 |
-8.59 |
0.22 |
0 |
|
|
332428 |
127250714 |
1 |
O2F3N3C20H26 |
A2B3C3D20E26 |
-198.11 |
3.81 |
-8.65 |
-0.66 |
0 |
|
|
332429 |
127250715 |
1 |
O2F3N3C20H26 |
A2B3C3D20E26 |
-200.07 |
3.37 |
-8.66 |
-0.51 |
0 |
|
|
332430 |
127250716 |
1 |
FN3O3C23H26 |
AB3C3D23E26 |
-82.37 |
4.01 |
-8.88 |
-0.04 |
0 |