List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
439645 |
135229432 |
1 |
NO2H41C70 |
AB2C41D70 |
246.01 |
1.91 |
-8.14 |
-0.69 |
0 |
|
|
439646 |
135229433 |
1 |
NOH43C70 |
ABC43D70 |
269.77 |
1.18 |
-8.21 |
-0.67 |
0 |
|
|
439647 |
135229434 |
1 |
NOH43C70 |
ABC43D70 |
269.0 |
0.39 |
-8.1 |
-0.67 |
0 |
|
|
439648 |
135229435 |
1 |
NOH43C70 |
ABC43D70 |
273.29 |
1.01 |
-8.28 |
-0.67 |
0 |
|
|
439649 |
135229436 |
1 |
NOH51C83 |
ABC51D83 |
326.9 |
2.07 |
-7.86 |
-0.62 |
0 |
|
|
439650 |
135229437 |
1 |
NOH51C83 |
ABC51D83 |
327.03 |
1.21 |
-7.91 |
-0.69 |
0 |
|
|
439651 |
135229438 |
1 |
NOH43C70 |
ABC43D70 |
268.54 |
0.9 |
-8.03 |
-0.68 |
0 |
|
|
439652 |
135229439 |
1 |
NOH45C66 |
ABC45D66 |
219.16 |
1.28 |
-8.09 |
-0.7 |
0 |
|
|
439653 |
135229440 |
1 |
NO2H43C70 |
AB2C43D70 |
238.39 |
0.81 |
-7.94 |
-0.66 |
0 |
|
|
439654 |
135229441 |
1 |
O2H48C73 |
A2B48C73 |
219.46 |
1.04 |
-8.41 |
-0.66 |
0 |
|
|
439655 |
135229442 |
1 |
NOH41C60 |
ABC41D60 |
196.2 |
1.35 |
-8.17 |
-0.65 |
0 |
|
|
439656 |
135229443 |
1 |
NO2H43C70 |
AB2C43D70 |
245.13 |
0.56 |
-8.05 |
-0.72 |
0 |
|
|
439657 |
135229444 |
1 |
NOH41C60 |
ABC41D60 |
196.61 |
1.57 |
-8.1 |
-0.68 |
0 |
|
|
439658 |
135229445 |
1 |
NOH37C57 |
ABC37D57 |
206.83 |
0.81 |
-8.18 |
-0.69 |
0 |
|
|
439659 |
135229446 |
1 |
OSN3C14H21 |
ABC3D14E21 |
-11.79 |
5.0 |
-8.36 |
0.01 |
0 |
|
|
439660 |
135229447 |
1 |
O2S2N7C30H37 |
A2B2C7D30E37 |
56.6 |
4.38 |
-8.44 |
-1.17 |
0 |
|
|
439661 |
135229448 |
1 |
NOH45C66 |
ABC45D66 |
220.64 |
2.02 |
-8.12 |
-0.63 |
0 |
|
|
439662 |
135229449 |
1 |
NOH45C66 |
ABC45D66 |
217.47 |
1.08 |
-7.94 |
-0.65 |
0 |
|
|
439663 |
135229450 |
1 |
NOH45C66 |
ABC45D66 |
218.81 |
1.28 |
-8.12 |
-0.64 |
0 |
|
|
439664 |
135229451 |
1 |
NOH41C60 |
ABC41D60 |
195.06 |
1.63 |
-7.97 |
-0.64 |
0 |
|
|
439665 |
135229453 |
1 |
NO2H43C66 |
AB2C43D66 |
197.95 |
1.61 |
-8.2 |
-0.71 |
0 |
|
|
439666 |
135229454 |
1 |
NO2H43C66 |
AB2C43D66 |
193.1 |
2.44 |
-7.88 |
-0.67 |
0 |
|
|
439667 |
135229455 |
1 |
NO2H43C66 |
AB2C43D66 |
195.8 |
1.22 |
-8.1 |
-0.73 |
0 |
|
|
439668 |
135229456 |
1 |
NO2H45C66 |
AB2C45D66 |
198.48 |
3.12 |
-8.05 |
-0.79 |
0 |
|
|
439669 |
135229462 |
1 |
NO2H51C82 |
AB2C51D82 |
289.3 |
2.77 |
-8.16 |
-0.69 |
0 |
|
|
439670 |
135229471 |
1 |
NO2H43C69 |
AB2C43D69 |
227.39 |
1.28 |
-8.05 |
-0.66 |
0 |
|
|
439671 |
135229473 |
1 |
NO2H43C69 |
AB2C43D69 |
229.88 |
1.04 |
-8.03 |
-0.64 |
0 |
|
|
439672 |
135229474 |
1 |
NOH29C45 |
ABC29D45 |
159.43 |
0.54 |
-8.02 |
-0.66 |
0 |
|
|
439673 |
135229475 |
1 |
NOH37C54 |
ABC37D54 |
171.06 |
0.8 |
-7.88 |
-0.68 |
0 |
|
|
439674 |
135229476 |
2 |
NOH36C57 |
ABC36D57 |
416.7 |
1.17 |
-8.01 |
-0.7 |
0 |
|
|
439675 |
135229477 |
1 |
NOH41C60 |
ABC41D60 |
194.3 |
0.79 |
-7.91 |
-0.66 |
0 |
|
|
439676 |
135229478 |
1 |
NOH33C51 |
ABC33D51 |
182.54 |
0.55 |
-7.98 |
-0.65 |
0 |
|
|
439677 |
135229479 |
1 |
NO2H43C70 |
AB2C43D70 |
244.88 |
2.05 |
-8.2 |
-0.75 |
0 |
|
|
439678 |
135229480 |
1 |
NOSH43C69 |
ABCD43E69 |
257.58 |
1.99 |
-7.98 |
-0.66 |
0 |
|
|
439679 |
135229481 |
1 |
NOSH43C69 |
ABCD43E69 |
257.81 |
2.01 |
-7.94 |
-0.69 |
0 |
|
|
439680 |
135229482 |
1 |
NOSH43C69 |
ABCD43E69 |
257.69 |
0.56 |
-7.96 |
-0.74 |
0 |
|
|
439681 |
135229483 |
1 |
NO2H43C70 |
AB2C43D70 |
239.04 |
0.7 |
-7.98 |
-0.66 |
0 |
|
|
439682 |
135229484 |
1 |
NO2H43C70 |
AB2C43D70 |
253.7 |
2.48 |
-7.98 |
-0.68 |
0 |
|
|
439683 |
135229485 |
1 |
NO2H43C69 |
AB2C43D69 |
226.65 |
1.24 |
-8.06 |
-0.68 |
0 |
|
|
439684 |
135229486 |
1 |
NO2H43C69 |
AB2C43D69 |
226.89 |
1.55 |
-8.04 |
-0.67 |
0 |
|
|
439685 |
135229487 |
1 |
NOH43C70 |
ABC43D70 |
267.57 |
0.6 |
-8.0 |
-0.65 |
0 |
|
|
439686 |
135229488 |
1 |
NOH51C83 |
ABC51D83 |
327.72 |
0.81 |
-8.1 |
-0.66 |
0 |
|
|
439687 |
135229489 |
1 |
OS2N7C29H33 |
AB2C7D29E33 |
129.26 |
3.24 |
-8.45 |
-1.15 |
0 |
|
|
439688 |
135229490 |
1 |
NOH41C60 |
ABC41D60 |
199.68 |
1.39 |
-8.22 |
-0.68 |
0 |
|
|
439689 |
135229491 |
1 |
NOH41C60 |
ABC41D60 |
196.09 |
1.28 |
-7.95 |
-0.72 |
0 |
|
|
439690 |
135229492 |
1 |
NOH41C60 |
ABC41D60 |
195.96 |
1.28 |
-7.96 |
-0.72 |
0 |
|
|
439691 |
135229493 |
1 |
FNOC10H16 |
ABCD10E16 |
-66.99 |
2.06 |
-9.46 |
0.24 |
0 |
|
|
439692 |
135229495 |
1 |
SN4C14H24 |
AB4C14D24 |
22.8 |
3.66 |
-8.39 |
-0.02 |
0 |
|
|
439693 |
135229496 |
1 |
NOH41C60 |
ABC41D60 |
197.23 |
1.75 |
-8.03 |
-0.66 |
0 |
|
|
439694 |
135229497 |
1 |
NOH41C60 |
ABC41D60 |
196.39 |
1.29 |
-8.06 |
-0.69 |
0 |
|
|
439695 |
135229498 |
1 |
NOH55C89 |
ABC55D89 |
352.43 |
0.82 |
-8.16 |
-0.67 |
0 |
|
|
439696 |
135229499 |
1 |
NOH55C89 |
ABC55D89 |
352.61 |
2.2 |
-8.16 |
-0.61 |
0 |
|
|
439697 |
135229500 |
1 |
NOH59C90 |
ABC59D90 |
336.24 |
1.55 |
-8.09 |
-0.6 |
0 |
|
|
439698 |
135229501 |
1 |
NO2H43C70 |
AB2C43D70 |
243.5 |
1.58 |
-8.22 |
-0.7 |
0 |
|
|
439699 |
135229502 |
1 |
SO2N7C28H35 |
AB2C7D28E35 |
15.44 |
4.65 |
-8.28 |
-0.68 |
0 |
|
|
439700 |
135229503 |
1 |
NO2H47C72 |
AB2C47D72 |
217.01 |
1.94 |
-7.85 |
-0.69 |
0 |
|
|
439701 |
135229504 |
1 |
FSO2N8C36H39 |
ABC2D8E36F39 |
21.24 |
8.04 |
-8.31 |
-0.78 |
0 |
|
|
439702 |
135229505 |
1 |
NO2H47C72 |
AB2C47D72 |
217.6 |
0.61 |
-7.84 |
-0.7 |
0 |
|
|
439703 |
135229506 |
1 |
NO2H47C72 |
AB2C47D72 |
216.28 |
2.21 |
-7.95 |
-0.72 |
0 |
|
|
439704 |
135229507 |
2 |
N2C7H7 |
A2B7C7 |
83.09 |
5.65 |
-8.26 |
-0.57 |
0 |
|
|
439705 |
135229508 |
1 |
NOH45C69 |
ABC45D69 |
251.57 |
0.68 |
-8.1 |
-0.68 |
0 |
|
|
439706 |
135229509 |
1 |
ON2H56C88 |
AB2C56D88 |
345.67 |
2.01 |
-7.82 |
-0.73 |
0 |
|
|
439707 |
135229510 |
1 |
NOH45C69 |
ABC45D69 |
251.88 |
0.24 |
-8.09 |
-0.69 |
0 |
|
|
439708 |
135229511 |
1 |
NO2H39C63 |
AB2C39D63 |
207.03 |
1.83 |
-8.08 |
-0.65 |
0 |
|
|
439709 |
135229512 |
1 |
NO2H39C63 |
AB2C39D63 |
204.16 |
1.69 |
-8.19 |
-0.69 |
0 |
|
|
439710 |
135229513 |
1 |
NO2H39C63 |
AB2C39D63 |
204.5 |
1.63 |
-8.15 |
-0.68 |
0 |
|
|
439711 |
135229514 |
1 |
NO2H47C72 |
AB2C47D72 |
220.38 |
1.35 |
-7.92 |
-0.68 |
0 |
|
|
439712 |
135229515 |
1 |
ON2H56C88 |
AB2C56D88 |
350.64 |
2.91 |
-7.96 |
-0.65 |
0 |
|
|
439713 |
135229516 |
1 |
NOH53C78 |
ABC53D78 |
263.78 |
1.77 |
-7.99 |
-0.65 |
0 |
|
|
439714 |
135229517 |
1 |
NO2H47C72 |
AB2C47D72 |
215.73 |
1.67 |
-8.08 |
-0.67 |
0 |
|
|
439715 |
135229518 |
1 |
NO2H47C72 |
AB2C47D72 |
217.16 |
1.33 |
-7.98 |
-0.68 |
0 |
|
|
439716 |
135229519 |
1 |
NOH41C60 |
ABC41D60 |
195.52 |
0.53 |
-7.78 |
-0.68 |
0 |
|
|
439717 |
135229520 |
1 |
NOH41C63 |
ABC41D63 |
231.51 |
1.89 |
-8.0 |
-0.62 |
0 |
|
|
439718 |
135229521 |
1 |
NOH41C63 |
ABC41D63 |
229.97 |
1.51 |
-7.88 |
-0.64 |
0 |
|
|
439719 |
135229522 |
1 |
O3N9C37H37 |
A3B9C37D37 |
98.94 |
10.34 |
-8.58 |
-0.87 |
0 |
|
|
439720 |
135229523 |
1 |
ClOF2N5C27H36 |
ABC2D5E27F36 |
-72.45 |
1.98 |
-8.49 |
-0.65 |
0 |
|
|
439721 |
135229524 |
1 |
NO2H43C66 |
AB2C43D66 |
193.55 |
2.01 |
-8.01 |
-0.68 |
0 |
|
|
439722 |
135229525 |
1 |
ClF2O2N5C30H32 |
AB2C2D5E30F32 |
-103.83 |
6.17 |
-8.71 |
-1.1 |
0 |
|
|
439723 |
135229526 |
1 |
NO2H43C66 |
AB2C43D66 |
192.41 |
1.6 |
-7.99 |
-0.68 |
0 |
|
|
439724 |
135229527 |
1 |
NOH41C63 |
ABC41D63 |
229.55 |
0.63 |
-7.95 |
-0.66 |
0 |
|
|
439725 |
135229528 |
1 |
NOH41C60 |
ABC41D60 |
197.84 |
1.68 |
-8.02 |
-0.58 |
0 |
|
|
439726 |
135229529 |
1 |
NOH41C63 |
ABC41D63 |
229.76 |
0.67 |
-8.01 |
-0.64 |
0 |
|
|
439727 |
135229530 |
1 |
NOH51C83 |
ABC51D83 |
333.69 |
2.15 |
-8.2 |
-0.61 |
0 |
|
|
439728 |
135229531 |
1 |
NOH51C83 |
ABC51D83 |
328.97 |
0.95 |
-8.28 |
-0.68 |
0 |
|
|
439729 |
135229532 |
1 |
NOH43C70 |
ABC43D70 |
275.01 |
1.21 |
-8.0 |
-0.61 |
0 |
|
|
439730 |
135229533 |
1 |
OS2N7C30H35 |
AB2C7D30E35 |
112.28 |
6.7 |
-8.34 |
-1.14 |
0 |
|
|
439731 |
135229534 |
1 |
ClF2N3C26H34 |
AB2C3D26E34 |
-31.26 |
4.8 |
-8.07 |
-0.76 |
0 |
|
|
439732 |
135229535 |
1 |
NC15H21 |
AB15C21 |
41.0 |
1.41 |
-8.03 |
0.43 |
0 |
|
|
439733 |
135229536 |
1 |
NOH41C63 |
ABC41D63 |
229.98 |
1.05 |
-8.18 |
-0.67 |
0 |
|
|
439734 |
135229537 |
1 |
NO2H35C57 |
AB2C35D57 |
181.93 |
1.95 |
-8.0 |
-0.69 |
0 |
|
|
439735 |
135229538 |
1 |
NOH41C63 |
ABC41D63 |
229.21 |
0.98 |
-8.05 |
-0.65 |
0 |
|
|
439736 |
135229539 |
1 |
NO2H51C82 |
AB2C51D82 |
286.59 |
2.6 |
-8.23 |
-0.71 |
0 |
|
|
439737 |
135229543 |
1 |
NOH43C70 |
ABC43D70 |
269.16 |
0.5 |
-8.19 |
-0.66 |
0 |
|
|
439738 |
135229547 |
1 |
PF3O3N4C23H28 |
AB3C3D4E23F28 |
-284.16 |
4.29 |
-9.11 |
-0.56 |
0 |
|
|
439739 |
135229552 |
1 |
NOH47C73 |
ABC47D73 |
257.3 |
0.99 |
-7.93 |
-0.69 |
0 |
|
|
439740 |
135229554 |
1 |
NOH37C57 |
ABC37D57 |
207.23 |
0.63 |
-8.18 |
-0.69 |
0 |
|
|
439741 |
135229555 |
1 |
NOH37C57 |
ABC37D57 |
207.3 |
0.74 |
-8.14 |
-0.7 |
0 |
|
|
439742 |
135229562 |
1 |
NOH47C73 |
ABC47D73 |
260.27 |
1.49 |
-8.14 |
-0.65 |
0 |
|
|
439743 |
135229563 |
1 |
NOH37C57 |
ABC37D57 |
206.83 |
1.25 |
-8.02 |
-0.72 |
0 |
|
|
439744 |
135229564 |
1 |
NOH37C57 |
ABC37D57 |
209.43 |
1.99 |
-7.91 |
-0.6 |
0 |