List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
433401 |
135173538 |
1 |
N2O6H14C15 |
A2B6C14D15 |
-202.3 |
4.35 |
-10.2 |
-1.9 |
0 |
|
|
433402 |
135173539 |
1 |
O4N6C27H32 |
A4B6C27D32 |
-77.5 |
6.27 |
-9.26 |
-0.83 |
0 |
|
|
433403 |
135173540 |
1 |
N7O7C38H41 |
A7B7C38D41 |
-135.06 |
5.8 |
-8.8 |
-0.72 |
0 |
|
|
433404 |
135173541 |
1 |
N6O7H42C47 |
A6B7C42D47 |
-82.78 |
11.39 |
-8.59 |
-2.01 |
0 |
|
|
433405 |
135173542 |
1 |
O5N7H35C40 |
A5B7C35D40 |
-46.77 |
5.61 |
-8.82 |
-1.74 |
0 |
|
|
433406 |
135173543 |
1 |
O5N7H37C41 |
A5B7C37D41 |
-53.31 |
6.8 |
-8.82 |
-0.88 |
0 |
|
|
433407 |
135173544 |
1 |
SF3N8O9H43C45 |
AB3C8D9E43F45 |
-364.48 |
12.04 |
-8.93 |
-1.59 |
0 |
|
|
433408 |
135173545 |
1 |
SN4O5C30H36 |
AB4C5D30E36 |
-164.09 |
2.26 |
-9.28 |
-0.78 |
0 |
|
|
433409 |
135173546 |
2 |
NO3C9H12 |
AB3C9D12 |
-259.96 |
6.38 |
-9.8 |
-0.86 |
0 |
|
|
433410 |
135173547 |
1 |
N2O6C17H18 |
A2B6C17D18 |
-217.04 |
6.09 |
-9.85 |
-1.59 |
0 |
|
|
433411 |
135173548 |
1 |
ON4C14H24 |
AB4C14D24 |
-14.64 |
1.48 |
-8.33 |
-0.12 |
0 |
|
|
433412 |
135173549 |
1 |
NO2C19H31 |
AB2C19D31 |
-101.07 |
1.99 |
-8.6 |
0.52 |
0 |
|
|
433413 |
135173550 |
1 |
O5N7H41C42 |
A5B7C41D42 |
-41.67 |
6.27 |
-8.57 |
-1.69 |
0 |
|
|
433414 |
135173551 |
1 |
O6N7C44H45 |
A6B7C44D45 |
-86.19 |
8.37 |
-8.72 |
-0.91 |
0 |
|
|
433415 |
135173552 |
1 |
F2S2N7O8C49H53 |
A2B2C7D8E49F53 |
-267.05 |
6.66 |
-8.67 |
-0.84 |
0 |
|
|
433416 |
135173553 |
1 |
S2F3O6N11C55H62 |
A2B3C6D11E55F62 |
-230.45 |
6.78 |
-8.38 |
-0.83 |
0 |
|
|
433417 |
135173554 |
1 |
SO3N4C22H40 |
AB3C4D22E40 |
-151.3 |
4.01 |
-8.55 |
0.4 |
0 |
|
|
433418 |
135173555 |
1 |
N2O7C26H30 |
A2B7C26D30 |
-260.53 |
6.42 |
-9.63 |
-1.62 |
0 |
|
|
433419 |
135173556 |
1 |
INO2C9H14 |
ABC2D9E14 |
-29.24 |
3.45 |
-9.66 |
-2.56 |
0 |
|
|
433420 |
135173557 |
1 |
N2O5H18C19 |
A2B5C18D19 |
-140.54 |
8.34 |
-9.49 |
-1.68 |
0 |
|
|
433421 |
135173558 |
1 |
O2N6C25H42 |
A2B6C25D42 |
6.39 |
3.26 |
-8.48 |
0.15 |
0 |
|
|
433422 |
135173559 |
2 |
O3N4C22H22 |
A3B4C22D22 |
-60.72 |
11.5 |
-8.41 |
-1.67 |
0 |
|
|
433423 |
135173560 |
2 |
NO2C14H14 |
AB2C14D14 |
-95.35 |
3.13 |
-8.7 |
-0.76 |
0 |
|
|
433424 |
135173561 |
1 |
SO3N4C14H24 |
AB3C4D14E24 |
-129.86 |
1.94 |
-9.39 |
-0.44 |
0 |
|
|
433425 |
135173562 |
2 |
O3N4C23H23 |
A3B4C23D23 |
-54.47 |
5.77 |
-8.86 |
-1.54 |
0 |
|
|
433426 |
135173563 |
1 |
OSN2C8H18 |
ABC2D8E18 |
-47.73 |
2.04 |
-8.17 |
0.42 |
0 |
|
|
433427 |
135173564 |
1 |
S2F3O8N10C53H59 |
A2B3C8D10E53F59 |
-288.14 |
6.44 |
-8.36 |
-0.78 |
0 |
|
|
433428 |
135173565 |
1 |
NSO4C17H25 |
ABC4D17E25 |
-173.71 |
4.05 |
-9.18 |
-0.54 |
0 |
|
|
433429 |
135173566 |
1 |
SN2O4C15H22 |
AB2C4D15E22 |
-166.03 |
8.96 |
-9.3 |
-0.73 |
0 |
|
|
433430 |
135173567 |
1 |
S2O6C17H18 |
A2B6C17D18 |
-182.6 |
5.83 |
-9.98 |
-0.89 |
0 |
|
|
433431 |
135173568 |
1 |
NSO4C18H25 |
ABC4D18E25 |
-157.34 |
1.67 |
-9.38 |
-0.54 |
0 |
|
|
433432 |
135173569 |
1 |
NSO4C19H27 |
ABC4D19E27 |
-177.83 |
4.96 |
-9.13 |
-0.57 |
0 |
|
|
433433 |
135173570 |
1 |
NSO4C16H23 |
ABC4D16E23 |
-175.52 |
3.54 |
-9.64 |
-0.57 |
0 |
|
|
433434 |
135173571 |
1 |
BrSO5N7C40H44 |
ABC5D7E40F44 |
-71.94 |
5.95 |
-8.94 |
-0.78 |
0 |
|
|
433435 |
135173572 |
1 |
S2F3O5N11C58H68 |
A2B3C5D11E58F68 |
-210.28 |
9.2 |
-8.1 |
-0.74 |
0 |
|
|
433436 |
135173573 |
1 |
O2N5C30H33 |
A2B5C30D33 |
27.32 |
7.36 |
-7.92 |
-0.52 |
0 |
|
|
433437 |
135173574 |
1 |
S2F3O6N10C54H57 |
A2B3C6D10E54F57 |
-165.74 |
9.21 |
-8.22 |
-0.82 |
0 |
|
|
433438 |
135173575 |
1 |
SF2O5N9C42H45 |
AB2C5D9E42F45 |
-134.3 |
11.02 |
-8.64 |
-1.24 |
0 |
|
|
433439 |
135173576 |
1 |
SF2O6N9C44H49 |
AB2C6D9E44F49 |
-199.9 |
5.63 |
-8.49 |
-1.31 |
0 |
|
|
433440 |
135173577 |
1 |
N6O6H34C39 |
A6B6C34D39 |
-94.42 |
9.11 |
-9.06 |
-1.14 |
0 |
|
|
433441 |
135173578 |
1 |
SF2N5O5H27C28 |
AB2C5D5E27F28 |
-215.15 |
5.28 |
-9.0 |
-1.03 |
0 |
|
|
433442 |
135173579 |
1 |
N7O8C39H41 |
A7B8C39D41 |
-185.24 |
12.68 |
-8.87 |
-1.51 |
0 |
|
|
433443 |
135173580 |
1 |
SN8O9C50H62 |
AB8C9D50E62 |
-226.17 |
5.88 |
-8.9 |
-0.78 |
0 |
|
|
433444 |
135173581 |
1 |
N7O7C37H37 |
A7B7C37D37 |
-137.12 |
10.66 |
-8.81 |
-1.68 |
0 |
|
|
433445 |
135173582 |
1 |
SN8O10C57H66 |
AB8C10D57E66 |
-233.35 |
9.73 |
-8.88 |
-0.76 |
0 |
|
|
433446 |
135173583 |
1 |
SN4O6C34H42 |
AB4C6D34E42 |
-201.96 |
5.53 |
-9.24 |
-1.06 |
0 |
|
|
433447 |
135173584 |
1 |
SN8O11C59H70 |
AB8C11D59E70 |
-226.2 |
8.32 |
-8.88 |
-0.9 |
0 |
|
|
433448 |
135173585 |
1 |
SF3O3N7C36H40 |
AB3C3D7E36F40 |
-153.45 |
6.99 |
-8.16 |
-0.7 |
0 |
|
|
433449 |
135173586 |
1 |
N5O7H35C40 |
A5B7C35D40 |
-86.23 |
7.76 |
-8.64 |
-1.79 |
0 |
|
|
433450 |
135173587 |
1 |
N6O7H30C38 |
A6B7C30D38 |
-84.96 |
7.12 |
-8.8 |
-1.87 |
0 |
|
|
433451 |
135173588 |
1 |
N7O11C45H53 |
A7B11C45D53 |
-307.78 |
7.67 |
-8.89 |
-1.58 |
0 |
|
|
433452 |
135173589 |
1 |
F2S2O7N9C44H49 |
A2B2C7D9E44F49 |
-270.53 |
5.6 |
-8.75 |
-0.96 |
0 |
|
|
433453 |
135173590 |
1 |
N2O3C19H22 |
A2B3C19D22 |
-52.15 |
5.3 |
-9.14 |
-0.34 |
0 |
|
|
433454 |
135173591 |
1 |
NSO3C11H21 |
ABC3D11E21 |
-130.1 |
5.22 |
-9.49 |
0.48 |
0 |
|
|
433455 |
135173592 |
1 |
NO2C11H19 |
AB2C11D19 |
-98.11 |
3.25 |
-9.44 |
0.95 |
0 |
|
|
433456 |
135173593 |
1 |
SN2O5C23H26 |
AB2C5D23E26 |
-94.49 |
7.99 |
-9.08 |
-0.3 |
0 |
|
|
433457 |
135173594 |
1 |
ION2C11H21 |
ABC2D11E21 |
-33.0 |
2.87 |
-8.56 |
-1.65 |
0 |
|
|
433458 |
135173595 |
1 |
NSO3C10H19 |
ABC3D10E19 |
-148.66 |
6.89 |
-9.45 |
0.46 |
0 |
|
|
433459 |
135173596 |
2 |
N3O4C19H20 |
A3B4C19D20 |
-165.36 |
7.87 |
-8.94 |
-0.89 |
0 |
|
|
433460 |
135173597 |
1 |
SN2O3C23H26 |
AB2C3D23E26 |
-9.29 |
5.77 |
-8.67 |
-0.36 |
0 |
|
|
433461 |
135173598 |
1 |
F2S2O7N9C47H55 |
A2B2C7D9E47F55 |
-290.17 |
8.43 |
-8.68 |
-0.88 |
0 |
|
|
433462 |
135173599 |
1 |
ON2S2C15H24 |
AB2C2D15E24 |
-18.81 |
2.75 |
-8.13 |
-0.41 |
0 |
|
|
433463 |
135173600 |
2 |
NO3C11H11 |
AB3C11D11 |
-192.47 |
6.85 |
-9.7 |
-1.69 |
0 |
|
|
433464 |
135173601 |
1 |
SN2O3C22H22 |
AB2C3D22E22 |
15.51 |
8.39 |
-8.65 |
-0.63 |
0 |
|
|
433465 |
135173602 |
1 |
SO5N6C46H48 |
AB5C6D46E48 |
-81.42 |
7.16 |
-8.5 |
-0.98 |
0 |
|
|
433466 |
135173603 |
1 |
SN2O5C24H24 |
AB2C5D24E24 |
-104.65 |
5.63 |
-9.08 |
-0.48 |
0 |
|
|
433467 |
135173604 |
1 |
FSN2O5H23C24 |
ABC2D5E23F24 |
-152.64 |
3.6 |
-9.14 |
-0.55 |
0 |
|
|
433468 |
135173605 |
1 |
SN4O4C31H38 |
AB4C4D31E38 |
-130.64 |
4.12 |
-9.09 |
-0.66 |
0 |
|
|
433469 |
135173606 |
1 |
SN4O4C24H28 |
AB4C4D24E28 |
-79.95 |
5.43 |
-9.35 |
-0.96 |
0 |
|
|
433470 |
135173607 |
1 |
INO2C9H18 |
ABC2D9E18 |
-68.61 |
3.6 |
-9.6 |
-0.84 |
0 |
|
|
433471 |
135173608 |
1 |
NOSC13H29 |
ABCD13E29 |
-92.73 |
1.85 |
-8.48 |
0.8 |
0 |
|
|
433472 |
135173609 |
1 |
NO2C9H17 |
AB2C9D17 |
-40.95 |
2.27 |
-9.41 |
1.13 |
0 |
|
|
433473 |
135173610 |
1 |
N7O7H41C44 |
A7B7C41D44 |
-122.42 |
4.17 |
-8.46 |
-1.58 |
0 |
|
|
433474 |
135173611 |
1 |
NO2S2C15H21 |
AB2C2D15E21 |
-60.79 |
4.3 |
-8.59 |
-0.66 |
0 |
|
|
433475 |
135173612 |
1 |
N6O7H38C45 |
A6B7C38D45 |
-33.23 |
12.93 |
-7.49 |
-1.86 |
0 |
|
|
433476 |
135173613 |
1 |
N5O7H37C46 |
A5B7C37D46 |
-109.02 |
13.57 |
-8.96 |
-1.78 |
0 |
|
|
433477 |
135173614 |
1 |
IO4N8H37C40 |
AB4C8D37E40 |
21.52 |
4.84 |
-8.52 |
-1.55 |
0 |
|
|
433478 |
135173615 |
1 |
O4N8H42C43 |
A4B8C42D43 |
-0.3 |
6.59 |
-8.53 |
-0.76 |
0 |
|
|
433479 |
135173616 |
1 |
NO3C11H19 |
AB3C11D19 |
-83.19 |
2.79 |
-9.87 |
0.06 |
0 |
|
|
433480 |
135173617 |
1 |
O5N7H39C42 |
A5B7C39D42 |
-42.46 |
3.85 |
-8.68 |
-1.52 |
0 |
|
|
433481 |
135173618 |
1 |
N2O3C20H24 |
A2B3C20D24 |
-63.09 |
5.09 |
-9.16 |
-0.37 |
0 |
|
|
433482 |
135173619 |
1 |
N2O3C21H32 |
A2B3C21D32 |
-127.02 |
3.0 |
-8.78 |
-0.52 |
0 |
|
|
433483 |
135173620 |
1 |
N6O6H42C47 |
A6B6C42D47 |
-45.91 |
11.92 |
-8.56 |
-1.89 |
0 |
|
|
433484 |
135173621 |
1 |
IN6O6H35C45 |
AB6C6D35E45 |
-34.88 |
3.01 |
-8.91 |
-1.74 |
0 |
|
|
433485 |
135173622 |
1 |
N7O7C43H45 |
A7B7C43D45 |
-123.55 |
12.86 |
-8.22 |
-1.61 |
0 |
|
|
433486 |
135173623 |
1 |
N2O5C25H32 |
A2B5C25D32 |
-178.34 |
3.64 |
-9.11 |
-0.32 |
0 |
|
|
433487 |
135173624 |
1 |
N2O4C21H24 |
A2B4C21D24 |
-100.53 |
3.27 |
-9.12 |
-0.34 |
0 |
|
|
433488 |
135173625 |
1 |
NO3C17H17 |
AB3C17D17 |
-2.63 |
3.94 |
-8.82 |
0.16 |
0 |
|
|
433489 |
135173626 |
1 |
SN2O4C21H26 |
AB2C4D21E26 |
-87.93 |
6.79 |
-8.41 |
-0.34 |
0 |
|
|
433490 |
135173627 |
2 |
O3N4H20C21 |
A3B4C20D21 |
-60.48 |
6.91 |
-8.8 |
-0.97 |
0 |
|
|
433491 |
135173628 |
1 |
NO3C18H27 |
AB3C18D27 |
-90.79 |
3.13 |
-8.75 |
-0.15 |
0 |
|
|
433492 |
135173629 |
1 |
N2O3C22H32 |
A2B3C22D32 |
-64.71 |
2.14 |
-8.16 |
-0.03 |
0 |
|
|
433493 |
135173630 |
1 |
NF3O3C21H26 |
AB3C3D21E26 |
-208.67 |
6.6 |
-9.12 |
-0.77 |
0 |
|
|
433494 |
135173631 |
3 |
NOC4H9 |
ABC4D9 |
-135.13 |
2.18 |
-8.39 |
1.1 |
0 |
|
|
433495 |
135173632 |
1 |
SF3N6O12H43C45 |
AB3C6D12E43F45 |
-495.45 |
9.71 |
-8.94 |
-1.56 |
0 |
|
|
433496 |
135173633 |
2 |
N3O5C22H22 |
A3B5C22D22 |
-230.57 |
9.53 |
-8.69 |
-1.13 |
0 |
|
|
433497 |
135173634 |
1 |
S2F3N8O12C61H65 |
A2B3C8D12E61F65 |
-470.29 |
16.37 |
-8.68 |
-1.0 |
0 |
|
|
433498 |
135173635 |
1 |
S2F3N8O14C65H73 |
A2B3C8D14E65F73 |
-556.59 |
4.82 |
-8.72 |
-0.82 |
0 |
|
|
433499 |
135173636 |
2 |
N3O4H17C20 |
A3B4C17D20 |
-130.61 |
8.92 |
-8.77 |
-1.59 |
0 |
|
|
433500 |
135173637 |
1 |
N2O3C16H20 |
A2B3C16D20 |
-99.04 |
6.62 |
-9.76 |
-0.29 |
0 |