List Systems
Back
Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
94298 |
49999451 |
1 |
O5N6C40H56 |
A5B6C40D56 |
-221.89 |
11.58 |
-8.7 |
-0.72 |
0 |
|
|
94299 |
49999453 |
1 |
ClO5N6C42H51 |
AB5C6D42E51 |
-185.5 |
10.64 |
-8.87 |
-0.98 |
0 |
|
|
94300 |
49999515 |
1 |
N6O6C43H62 |
A6B6C43D62 |
-278.55 |
1.56 |
-9.08 |
-0.48 |
0 |
|
|
94301 |
49999516 |
1 |
N6O7C41H58 |
A6B7C41D58 |
-309.57 |
1.0 |
-8.84 |
-0.35 |
0 |
|
|
94302 |
49999520 |
2 |
N3O3C19H27 |
A3B3C19D27 |
-280.95 |
6.36 |
-8.36 |
-0.13 |
0 |
|
|
94303 |
49999535 |
1 |
O5N6C42H58 |
A5B6C42D58 |
-235.39 |
8.7 |
-8.56 |
-0.24 |
0 |
|
|
94304 |
49999536 |
1 |
O5N6C39H54 |
A5B6C39D54 |
-231.64 |
8.58 |
-8.66 |
-0.57 |
0 |
|
|
94305 |
49999541 |
1 |
O5N6C42H60 |
A5B6C42D60 |
-244.79 |
2.7 |
-8.78 |
-0.16 |
0 |
|
|
94306 |
49999542 |
1 |
O5N6C43H62 |
A5B6C43D62 |
-250.9 |
4.89 |
-8.87 |
-0.24 |
0 |
|
|
94307 |
49999545 |
1 |
O5N6C43H62 |
A5B6C43D62 |
-261.79 |
6.49 |
-8.9 |
-0.23 |
0 |
|
|
94308 |
49999546 |
1 |
O5N6C44H64 |
A5B6C44D64 |
-265.0 |
10.04 |
-8.79 |
-0.19 |
0 |
|
|
94309 |
49999547 |
1 |
O5N6C41H60 |
A5B6C41D60 |
-258.78 |
2.01 |
-9.04 |
-0.3 |
0 |
|
|
94310 |
49999548 |
1 |
O5N6C38H54 |
A5B6C38D54 |
-233.43 |
6.4 |
-8.83 |
-0.3 |
0 |
|
|
94311 |
49999549 |
1 |
O5N6C41H60 |
A5B6C41D60 |
-239.93 |
7.9 |
-8.8 |
-0.47 |
0 |
|
|
94313 |
49999587 |
1 |
FO5N6C44H57 |
AB5C6D44E57 |
-263.26 |
11.7 |
-8.95 |
-0.43 |
0 |
|
|
94314 |
49999588 |
1 |
F2O5N6C43H54 |
A2B5C6D43E54 |
-302.47 |
8.09 |
-8.98 |
-0.5 |
0 |
|
|
94315 |
49999589 |
1 |
O5N6C43H56 |
A5B6C43D56 |
-205.67 |
8.26 |
-8.65 |
-0.32 |
0 |
|
|
94316 |
49999590 |
1 |
FO5N6C43H55 |
AB5C6D43E55 |
-256.65 |
10.82 |
-8.72 |
-0.44 |
0 |
|
|
94317 |
49999638 |
1 |
O5N6C43H62 |
A5B6C43D62 |
-255.16 |
7.66 |
-9.0 |
-0.33 |
0 |
|
|
94318 |
49999652 |
1 |
FO5N6C38H53 |
AB5C6D38E53 |
-283.6 |
6.17 |
-8.75 |
-0.21 |
0 |
|
|
94319 |
49999655 |
1 |
F2O5N6C43H54 |
A2B5C6D43E54 |
-300.8 |
8.94 |
-8.7 |
-0.61 |
0 |
|
|
94320 |
49999656 |
1 |
FO5N6C42H59 |
AB5C6D42E59 |
-296.96 |
9.34 |
-8.77 |
-0.23 |
0 |
|
|
94321 |
49999657 |
1 |
FN6O6C43H55 |
AB6C6D43E55 |
-288.17 |
2.08 |
-8.7 |
-0.33 |
0 |
|
|
94322 |
49999659 |
1 |
FO5N6C43H55 |
AB5C6D43E55 |
-251.33 |
8.51 |
-8.77 |
-0.43 |
0 |
|
|
94323 |
49999671 |
1 |
O5N6C42H58 |
A5B6C42D58 |
-238.67 |
9.88 |
-8.86 |
-0.38 |
0 |
|
|
94324 |
49999676 |
1 |
O5N6C41H60 |
A5B6C41D60 |
-263.25 |
7.73 |
-8.64 |
-0.81 |
0 |
|
|
94325 |
49999712 |
1 |
F2O5N6C43H52 |
A2B5C6D43E52 |
-278.52 |
7.34 |
-8.88 |
-0.54 |
0 |
|
|
94326 |
49999734 |
1 |
ClO5N6C40H55 |
AB5C6D40E55 |
-242.26 |
11.2 |
-8.76 |
-0.59 |
0 |
|
|
94327 |
49999735 |
1 |
ClO5N6C41H57 |
AB5C6D41E57 |
-249.1 |
3.33 |
-8.74 |
-0.75 |
0 |
|
|
94328 |
49999736 |
1 |
ClO5N6C42H59 |
AB5C6D42E59 |
-251.55 |
7.94 |
-8.93 |
-0.36 |
0 |
|
|
94329 |
49999755 |
1 |
FO5N6C43H53 |
AB5C6D43E53 |
-242.59 |
8.74 |
-8.83 |
-0.62 |
0 |
|
|
94330 |
49999756 |
1 |
FO5N6C44H55 |
AB5C6D44E55 |
-257.89 |
7.87 |
-8.6 |
-0.4 |
0 |
|
|
94331 |
49999758 |
1 |
O5N6C39H54 |
A5B6C39D54 |
-223.1 |
6.2 |
-8.69 |
-0.64 |
0 |
|
|
94332 |
49999759 |
1 |
O5N6C40H56 |
A5B6C40D56 |
-233.01 |
10.3 |
-8.94 |
-0.29 |
0 |
|
|
94333 |
49999761 |
1 |
O5N6C40H58 |
A5B6C40D58 |
-255.87 |
11.68 |
-8.52 |
-0.38 |
0 |
|
|
94334 |
49999764 |
1 |
O5N6C41H60 |
A5B6C41D60 |
-257.37 |
8.43 |
-8.76 |
-0.35 |
0 |
|
|
94335 |
49999767 |
1 |
O5N6C43H62 |
A5B6C43D62 |
-250.63 |
4.93 |
-8.98 |
-0.28 |
0 |
|
|
94336 |
49999770 |
1 |
O5N6C43H62 |
A5B6C43D62 |
-254.73 |
10.64 |
-8.89 |
-0.17 |
0 |
|
|
94337 |
49999772 |
1 |
ClO5N6C42H59 |
AB5C6D42E59 |
-263.61 |
7.79 |
-8.65 |
-0.91 |
0 |
|
|
94338 |
49999786 |
1 |
ClO5N6C38H53 |
AB5C6D38E53 |
-248.83 |
6.28 |
-8.51 |
-0.16 |
0 |
|
|
94339 |
49999787 |
1 |
ClO5N6C37H51 |
AB5C6D37E51 |
-248.6 |
4.23 |
-8.86 |
-0.59 |
0 |
|
|
94340 |
49999788 |
1 |
ClO5N6C40H57 |
AB5C6D40E57 |
-258.27 |
6.66 |
-8.71 |
-0.33 |
0 |
|
|
94341 |
49999789 |
1 |
ClO5N6C42H59 |
AB5C6D42E59 |
-265.19 |
7.08 |
-8.63 |
-0.23 |
0 |
|
|
94342 |
49999794 |
1 |
O5N6C40H56 |
A5B6C40D56 |
-237.77 |
12.16 |
-8.8 |
-0.32 |
0 |
|
|
94343 |
49999798 |
1 |
O5N6C43H60 |
A5B6C43D60 |
-243.16 |
3.96 |
-8.79 |
-0.23 |
0 |
|
|
94344 |
49999799 |
1 |
N6O6C41H56 |
A6B6C41D56 |
-264.92 |
8.08 |
-8.89 |
-0.34 |
0 |
|
|
94345 |
49999800 |
1 |
O5N6C42H58 |
A5B6C42D58 |
-232.52 |
8.94 |
-8.92 |
-0.27 |
0 |
|
|
94346 |
49999807 |
1 |
O5N6C41H60 |
A5B6C41D60 |
-246.61 |
9.49 |
-8.91 |
-0.46 |
0 |
|
|
94347 |
49999809 |
1 |
F2O5N6C43H54 |
A2B5C6D43E54 |
-305.49 |
6.38 |
-9.0 |
-0.52 |
0 |
|
|
94348 |
49999810 |
1 |
F2O5N6C43H54 |
A2B5C6D43E54 |
-297.66 |
5.02 |
-8.8 |
-0.69 |
0 |
|
|
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 |