List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
94349 |
49999812 |
1 |
FO5N6C44H57 |
AB5C6D44E57 |
-268.08 |
6.36 |
-8.79 |
-0.42 |
0 |
|
|
94350 |
49999813 |
1 |
F2O5N6C43H54 |
A2B5C6D43E54 |
-296.99 |
11.32 |
-9.0 |
-0.41 |
0 |
|
|
94351 |
49999814 |
1 |
O5N6C43H56 |
A5B6C43D56 |
-210.69 |
7.17 |
-8.79 |
-0.56 |
0 |
|
|
94352 |
49999815 |
1 |
FO5N6C43H55 |
AB5C6D43E55 |
-256.44 |
10.97 |
-8.91 |
-0.42 |
0 |
|
|
94353 |
49999818 |
1 |
ClO5N6C41H57 |
AB5C6D41E57 |
-253.29 |
2.42 |
-8.99 |
-0.6 |
0 |
|
|
94354 |
49999947 |
1 |
O5N6C38H52 |
A5B6C38D52 |
-223.75 |
8.7 |
-8.74 |
-0.69 |
0 |
|
|
94355 |
49999948 |
1 |
O5N6C39H54 |
A5B6C39D54 |
-233.1 |
12.28 |
-8.61 |
-0.81 |
0 |
|
|
94356 |
49999967 |
1 |
O5N6C40H56 |
A5B6C40D56 |
-232.34 |
3.83 |
-9.01 |
-0.29 |
0 |
|
|
94357 |
49999968 |
1 |
O5N6C41H58 |
A5B6C41D58 |
-240.15 |
3.81 |
-8.84 |
-0.21 |
0 |
|
|
94359 |
49999980 |
1 |
FO5N6C41H51 |
AB5C6D41E51 |
-239.31 |
10.36 |
-8.75 |
-0.63 |
0 |
|
|
94360 |
50000078 |
1 |
ClO5N6C39H53 |
AB5C6D39E53 |
-231.5 |
9.57 |
-9.14 |
-0.52 |
0 |
|
|
94361 |
50000097 |
1 |
O5N6C40H56 |
A5B6C40D56 |
-229.25 |
10.53 |
-8.89 |
-0.53 |
0 |
|
|
94362 |
50000106 |
1 |
F2O5N6C40H48 |
A2B5C6D40E48 |
-280.13 |
8.13 |
-9.12 |
-0.68 |
0 |
|
|
94363 |
50000110 |
1 |
O5N6C41H52 |
A5B6C41D52 |
-199.85 |
6.07 |
-8.74 |
-0.68 |
0 |
|
|
94364 |
50000112 |
1 |
F2O5N6C40H48 |
A2B5C6D40E48 |
-287.12 |
7.4 |
-8.87 |
-0.99 |
0 |
|
|
94365 |
50000113 |
1 |
FO5N6C40H49 |
AB5C6D40E49 |
-240.63 |
6.58 |
-8.73 |
-0.92 |
0 |
|
|
94366 |
50000122 |
1 |
N6O6C37H52 |
A6B6C37D52 |
-253.02 |
6.3 |
-8.84 |
-0.38 |
0 |
|
|
94367 |
50000261 |
1 |
FO5N6C38H53 |
AB5C6D38E53 |
-288.84 |
6.33 |
-8.7 |
-0.37 |
0 |
|
|
94368 |
50000268 |
1 |
ClO5N6C37H51 |
AB5C6D37E51 |
-251.45 |
4.14 |
-8.8 |
-0.32 |
0 |
|
|
94369 |
50000285 |
1 |
O5N6C41H58 |
A5B6C41D58 |
-243.13 |
9.06 |
-9.2 |
-0.28 |
0 |
|
|
94370 |
50000286 |
3 |
N2O2C13H18 |
A2B2C13D18 |
-266.28 |
9.41 |
-8.9 |
-0.4 |
0 |
|
|
94371 |
50000287 |
1 |
O5N6C40H56 |
A5B6C40D56 |
-232.65 |
8.7 |
-9.12 |
-0.45 |
0 |
|
|
94372 |
50000322 |
1 |
SO4N5C34H47 |
AB4C5D34E47 |
-180.76 |
3.05 |
-8.39 |
-0.13 |
0 |
|
|
94373 |
50000354 |
1 |
ClO5N6C37H51 |
AB5C6D37E51 |
-247.36 |
6.62 |
-8.39 |
-0.4 |
0 |
|
|
94374 |
50000355 |
1 |
ClO5N6C36H49 |
AB5C6D36E49 |
-243.54 |
9.57 |
-8.75 |
-0.57 |
0 |
|
|
94375 |
50000396 |
1 |
ClO4N5C35H48 |
AB4C5D35E48 |
-196.24 |
6.32 |
-8.82 |
-0.28 |
0 |
|
|
94376 |
50000409 |
1 |
O4N5C35H49 |
A4B5C35D49 |
-186.54 |
5.87 |
-8.74 |
-0.1 |
0 |
|
|
94377 |
50000428 |
1 |
F2O5N6C41H50 |
A2B5C6D41E50 |
-298.78 |
9.67 |
-8.75 |
-0.53 |
0 |
|
|
94378 |
50000430 |
1 |
ClO5N6C36H49 |
AB5C6D36E49 |
-226.1 |
6.92 |
-9.02 |
-0.77 |
0 |
|
|
94379 |
50000433 |
1 |
ClO5N6C37H51 |
AB5C6D37E51 |
-243.96 |
5.54 |
-9.07 |
-1.0 |
0 |
|
|
94380 |
50000444 |
1 |
Cl2O4N5C35H47 |
A2B4C5D35E47 |
-205.27 |
5.21 |
-8.79 |
-0.71 |
0 |
|
|
94381 |
50000453 |
1 |
O4N5C34H47 |
A4B5C34D47 |
-183.05 |
8.78 |
-8.46 |
-0.34 |
0 |
|
|
94382 |
50000457 |
1 |
BrO4N5C33H44 |
AB4C5D33E44 |
-178.26 |
6.67 |
-8.82 |
-0.4 |
0 |
|
|
94383 |
50000463 |
1 |
BrO4N5C34H46 |
AB4C5D34E46 |
-185.65 |
9.97 |
-8.56 |
-0.49 |
0 |
|
|
94384 |
50000545 |
1 |
SO4N7C31H45 |
AB4C7D31E45 |
-163.97 |
4.88 |
-8.85 |
-0.72 |
0 |
|
|
94385 |
50000550 |
1 |
F2O4N5C33H43 |
A2B4C5D33E43 |
-269.23 |
4.84 |
-8.96 |
-0.66 |
0 |
|
|
94386 |
50000551 |
1 |
F2O4N5C33H43 |
A2B4C5D33E43 |
-264.05 |
8.98 |
-8.85 |
-0.74 |
0 |
|
|
94387 |
50000569 |
6 |
NOC7H9 |
ABC7D9 |
-239.72 |
17.1 |
-8.5 |
-0.45 |
0 |
|
|
94388 |
50000610 |
1 |
ClO5N6C38H53 |
AB5C6D38E53 |
-250.33 |
5.24 |
-8.77 |
-0.74 |
0 |
|
|
94389 |
50000611 |
1 |
ClO5N6C35H47 |
AB5C6D35E47 |
-233.47 |
3.99 |
-8.97 |
-0.48 |
0 |
|
|
94390 |
50000627 |
1 |
N4O5C28H36 |
A4B5C28D36 |
-190.95 |
6.93 |
-8.59 |
-0.27 |
0 |
|
|
94391 |
50000629 |
1 |
O4N5C31H43 |
A4B5C31D43 |
-184.23 |
7.45 |
-8.47 |
-0.15 |
0 |
|
|
94392 |
50000632 |
1 |
N5O5C30H41 |
A5B5C30D41 |
-211.03 |
6.22 |
-8.73 |
-0.23 |
0 |
|
|
94393 |
50000661 |
1 |
O4N5C30H41 |
A4B5C30D41 |
-173.15 |
4.89 |
-8.52 |
-0.31 |
0 |
|
|
94394 |
50000662 |
1 |
SO4N7C28H41 |
AB4C7D28E41 |
-155.04 |
6.28 |
-9.36 |
-0.69 |
0 |
|
|
94395 |
50000670 |
1 |
ClFO4N5C29H37 |
ABC4D5E29F37 |
-225.16 |
4.58 |
-9.07 |
-0.5 |
0 |
|
|
94397 |
50000694 |
1 |
O3N4C29H40 |
A3B4C29D40 |
-136.12 |
6.79 |
-8.78 |
-0.02 |
0 |
|
|
94398 |
50000714 |
1 |
ClO5N6C42H51 |
AB5C6D42E51 |
-187.57 |
2.56 |
-8.93 |
-0.87 |
0 |
|
|
94399 |
50000745 |
1 |
O5N6C44H56 |
A5B6C44D56 |
-199.39 |
5.69 |
-8.32 |
-0.34 |
0 |
|
|
94400 |
50000764 |
1 |
BrO3N4C26H33 |
AB3C4D26E33 |
-109.17 |
3.01 |
-8.99 |
-0.46 |
0 |
|
|
94401 |
50000774 |
1 |
N6O6C43H54 |
A6B6C43D54 |
-233.14 |
13.64 |
-8.4 |
-0.42 |
0 |
|
|
94402 |
50000790 |
1 |
BrO3N4C26H33 |
AB3C4D26E33 |
-120.1 |
6.33 |
-8.9 |
-0.44 |
0 |
|
|
94403 |
50000791 |
1 |
O3N4C28H38 |
A3B4C28D38 |
-126.64 |
10.01 |
-8.78 |
-0.14 |
0 |
|
|
94404 |
50000795 |
1 |
FO5N6C42H51 |
AB5C6D42E51 |
-237.78 |
2.47 |
-8.8 |
-0.44 |
0 |
|
|
94405 |
50000806 |
1 |
FN6O6C43H53 |
AB6C6D43E53 |
-274.08 |
12.01 |
-8.06 |
-0.49 |
0 |
|
|
94406 |
50000812 |
1 |
FN6O6C43H53 |
AB6C6D43E53 |
-274.15 |
8.99 |
-8.64 |
-0.67 |
0 |
|
|
94407 |
50000814 |
1 |
ClO3N4C27H35 |
AB3C4D27E35 |
-131.62 |
9.39 |
-8.84 |
-0.34 |
0 |
|
|
94408 |
50000815 |
1 |
O3N4C27H36 |
A3B4C27D36 |
-127.86 |
3.3 |
-8.79 |
-0.11 |
0 |
|
|
94409 |
50000816 |
1 |
ClO5N6C38H51 |
AB5C6D38E51 |
-226.17 |
5.67 |
-8.9 |
-0.56 |
0 |
|
|
94411 |
50000824 |
1 |
ClN6O6C40H53 |
AB6C6D40E53 |
-266.57 |
5.86 |
-8.95 |
-0.6 |
0 |
|
|
94412 |
50000825 |
1 |
ClO5N6C41H55 |
AB5C6D41E55 |
-240.85 |
10.54 |
-9.2 |
-0.56 |
0 |
|
|
94413 |
50000826 |
1 |
ClO5N6C42H57 |
AB5C6D42E57 |
-239.99 |
3.71 |
-9.0 |
-0.58 |
0 |
|
|
94414 |
50000828 |
2 |
N3O3C22H28 |
A3B3C22D28 |
-231.06 |
8.48 |
-8.73 |
-0.44 |
0 |
|
|
94415 |
50000829 |
1 |
N6O6C43H54 |
A6B6C43D54 |
-223.02 |
4.85 |
-8.18 |
-0.32 |
0 |
|
|
94417 |
50000844 |
1 |
ClO5N6C43H53 |
AB5C6D43E53 |
-197.57 |
7.82 |
-8.57 |
-0.73 |
0 |
|
|
94418 |
50000845 |
1 |
N6O6C37H50 |
A6B6C37D50 |
-251.78 |
10.85 |
-8.8 |
-0.35 |
0 |
|
|
94419 |
50000851 |
1 |
FO5N6C43H53 |
AB5C6D43E53 |
-235.77 |
10.74 |
-8.53 |
-0.83 |
0 |
|
|
94420 |
50000852 |
1 |
O5N6C44H56 |
A5B6C44D56 |
-206.56 |
6.17 |
-8.38 |
-0.24 |
0 |
|
|
94421 |
50000857 |
1 |
FO5N6C43H53 |
AB5C6D43E53 |
-239.69 |
8.08 |
-8.55 |
-0.74 |
0 |
|
|
94422 |
50000860 |
2 |
N3O3C22H28 |
A3B3C22D28 |
-239.01 |
3.7 |
-8.32 |
-0.53 |
0 |
|
|
94423 |
50000892 |
1 |
O5N6C37H50 |
A5B6C37D50 |
-224.03 |
7.19 |
-8.91 |
-0.56 |
0 |
|
|
94425 |
50000917 |
1 |
O5N6C44H62 |
A5B6C44D62 |
-247.33 |
7.98 |
-8.88 |
-0.19 |
0 |
|
|
94426 |
50000949 |
1 |
FO5N6C37H49 |
AB5C6D37E49 |
-271.99 |
5.22 |
-8.69 |
-0.33 |
0 |
|
|
94427 |
50000968 |
1 |
ClO5N6C39H53 |
AB5C6D39E53 |
-243.58 |
10.59 |
-8.79 |
-0.8 |
0 |
|
|
94428 |
50000970 |
1 |
ClO5N6C39H53 |
AB5C6D39E53 |
-236.68 |
7.5 |
-8.8 |
-0.8 |
0 |