List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
72552 |
48416297 |
1 |
SN4O4C16H22 |
AB4C4D16E22 |
-149.61 |
5.19 |
-9.19 |
-0.29 |
0 |
|
|
72553 |
48416298 |
1 |
O3N5C18H31 |
A3B5C18D31 |
-165.53 |
6.07 |
-9.18 |
0.64 |
0 |
|
|
72554 |
48416299 |
1 |
O3N5C22H29 |
A3B5C22D29 |
-64.98 |
8.6 |
-9.26 |
-0.55 |
0 |
|
|
72555 |
48416300 |
1 |
F3O3N5C16H22 |
A3B3C5D16E22 |
-270.71 |
5.74 |
-9.57 |
0.24 |
0 |
|
|
72556 |
48416301 |
1 |
N3O3C23H27 |
A3B3C23D27 |
-89.12 |
3.9 |
-9.13 |
-0.15 |
0 |
|
|
72557 |
48416302 |
1 |
SO2N5C21H29 |
AB2C5D21E29 |
-69.62 |
6.88 |
-9.03 |
-1.07 |
0 |
|
|
72558 |
48416303 |
1 |
SO2N4C20H22 |
AB2C4D20E22 |
-24.32 |
7.71 |
-8.62 |
-0.55 |
0 |
|
|
72559 |
48416304 |
1 |
SO2N4C22H26 |
AB2C4D22E26 |
-46.74 |
6.54 |
-8.62 |
-0.57 |
0 |
|
|
72560 |
48416305 |
3 |
NOC6H9 |
ABC6D9 |
-148.88 |
10.38 |
-9.5 |
0.62 |
0 |
|
|
72561 |
48416306 |
1 |
O3N4C20H28 |
A3B4C20D28 |
-129.1 |
4.28 |
-9.09 |
-0.22 |
0 |
|
|
72562 |
48416307 |
1 |
ClFO3N4C19H20 |
ABC3D4E19F20 |
-104.24 |
5.68 |
-9.33 |
-0.76 |
0 |
|
|
72563 |
48416308 |
1 |
O2N4C21H26 |
A2B4C21D26 |
-50.37 |
4.46 |
-8.57 |
-0.65 |
0 |
|
|
72564 |
48416309 |
1 |
O3N4C21H26 |
A3B4C21D26 |
-88.14 |
6.68 |
-8.94 |
-0.6 |
0 |
|
|
72565 |
48416311 |
1 |
N3O3C18H25 |
A3B3C18D25 |
-122.0 |
2.66 |
-8.77 |
0.19 |
0 |
|
|
72566 |
48416312 |
1 |
N3O5C22H27 |
A3B5C22D27 |
-195.63 |
9.11 |
-9.0 |
-1.13 |
0 |
|
|
72567 |
48416313 |
1 |
O4N5C20H21 |
A4B5C20D21 |
-47.49 |
3.78 |
-9.54 |
-1.62 |
0 |
|
|
72568 |
48416314 |
1 |
F3N3O3C18H22 |
A3B3C3D18E22 |
-267.54 |
3.39 |
-9.26 |
-0.38 |
0 |
|
|
72569 |
48416315 |
1 |
ClFO2N5C20H23 |
ABC2D5E20F23 |
-83.07 |
6.1 |
-9.21 |
-0.78 |
0 |
|
|
72570 |
48416316 |
2 |
ON3C10H13 |
AB3C10D13 |
-36.3 |
7.18 |
-8.83 |
-0.56 |
0 |
|
|
72571 |
48416317 |
1 |
FO2N5C22H26 |
AB2C5D22E26 |
-78.25 |
5.33 |
-9.12 |
-0.76 |
0 |
|
|
72572 |
48416318 |
1 |
O3N5C19H25 |
A3B5C19D25 |
-104.76 |
4.61 |
-8.6 |
-0.14 |
0 |
|
|
72573 |
48416319 |
1 |
FO2N5C18H20 |
AB2C5D18E20 |
-68.69 |
5.15 |
-9.34 |
-0.6 |
0 |
|
|
72574 |
48416320 |
1 |
O4N5C20H23 |
A4B5C20D23 |
-96.1 |
6.26 |
-9.01 |
-0.69 |
0 |
|
|
72575 |
48416321 |
1 |
O2N5C19H23 |
A2B5C19D23 |
-19.25 |
0.96 |
-9.31 |
-0.53 |
0 |
|
|
72576 |
48416322 |
1 |
SO3N4C17H24 |
AB3C4D17E24 |
-116.13 |
5.81 |
-9.07 |
-0.16 |
0 |
|
|
72577 |
48416323 |
1 |
SO2N6C18H22 |
AB2C6D18E22 |
-11.57 |
2.37 |
-9.26 |
-0.87 |
0 |
|
|
72578 |
48416324 |
1 |
FO3N4C20H23 |
AB3C4D20E23 |
-126.62 |
4.97 |
-9.25 |
-0.88 |
0 |
|
|
72579 |
48416325 |
1 |
SO3N4C21H26 |
AB3C4D21E26 |
-81.57 |
8.62 |
-8.82 |
-0.78 |
0 |
|
|
72580 |
48416326 |
1 |
O4N5C20H25 |
A4B5C20D25 |
-88.89 |
4.53 |
-8.99 |
-0.6 |
0 |
|
|
72581 |
48416327 |
1 |
F2O3N4C18H22 |
A2B3C4D18E22 |
-206.2 |
3.76 |
-9.42 |
-0.86 |
0 |
|
|
72582 |
48416328 |
1 |
N3O4C22H25 |
A3B4C22D25 |
-107.58 |
2.39 |
-8.87 |
-0.37 |
0 |
|
|
72583 |
48416329 |
2 |
N2O2C9H12 |
A2B2C9D12 |
-141.84 |
6.33 |
-9.06 |
0.14 |
0 |
|
|
72584 |
48416330 |
1 |
O2N5C16H19 |
A2B5C16D19 |
-24.82 |
6.72 |
-9.15 |
-0.69 |
0 |
|
|
72585 |
48416331 |
1 |
ClSN3O3C16H20 |
ABC3D3E16F20 |
-104.71 |
5.83 |
-9.3 |
-1.04 |
0 |
|
|
72586 |
48416332 |
3 |
NOC7H9 |
ABC7D9 |
-120.95 |
4.09 |
-9.23 |
-0.48 |
0 |
|
|
72587 |
48416333 |
1 |
SO3N4C15H22 |
AB3C4D15E22 |
-130.27 |
6.4 |
-8.87 |
-0.29 |
0 |
|
|
72588 |
48416335 |
1 |
O2S2N5C16H17 |
A2B2C5D16E17 |
4.55 |
2.45 |
-8.78 |
-1.24 |
0 |
|
|
72589 |
48416336 |
1 |
O3N4C14H18 |
A3B4C14D18 |
-109.09 |
4.28 |
-9.11 |
-0.92 |
0 |
|
|
72590 |
48416337 |
1 |
O3N5C20H27 |
A3B5C20D27 |
-115.78 |
5.92 |
-8.86 |
-0.31 |
0 |
|
|
72591 |
48416338 |
1 |
FN3O3C18H24 |
AB3C3D18E24 |
-159.3 |
5.96 |
-8.94 |
-0.15 |
0 |
|
|
72592 |
48416339 |
1 |
ClO2N3C17H22 |
AB2C3D17E22 |
-85.91 |
2.63 |
-9.33 |
-0.1 |
0 |
|
|
72593 |
48416340 |
1 |
ClN3O4C18H22 |
AB3C4D18E22 |
-153.26 |
7.92 |
-9.12 |
-0.55 |
0 |
|
|
72594 |
48416341 |
1 |
O3N5C20H25 |
A3B5C20D25 |
-101.51 |
6.65 |
-9.07 |
-0.58 |
0 |
|
|
72595 |
48416343 |
1 |
O2N6C13H18 |
A2B6C13D18 |
-43.24 |
3.21 |
-9.06 |
-0.87 |
0 |
|
|
72596 |
48416344 |
1 |
ClSO3N4C18H21 |
ABC3D4E18F21 |
-120.15 |
3.66 |
-8.93 |
-0.88 |
0 |
|
|
72597 |
48416345 |
1 |
O2N3C19H27 |
A2B3C19D27 |
-94.23 |
6.04 |
-8.98 |
0.43 |
0 |
|
|
72598 |
48416346 |
1 |
O3N4C23H26 |
A3B4C23D26 |
-81.98 |
4.5 |
-9.32 |
-0.45 |
0 |
|
|
72599 |
48416347 |
1 |
O4N5C19H23 |
A4B5C19D23 |
-78.17 |
4.85 |
-9.15 |
-0.7 |
0 |
|
|
72600 |
48416348 |
1 |
O2N5C16H25 |
A2B5C16D25 |
-73.02 |
5.78 |
-8.92 |
0.81 |
0 |
|
|
72601 |
48416349 |
1 |
O3N4C19H22 |
A3B4C19D22 |
-83.43 |
5.35 |
-9.24 |
-1.11 |
0 |
|
|
72602 |
48416350 |
1 |
O4N5C19H29 |
A4B5C19D29 |
-195.1 |
8.12 |
-9.27 |
-0.01 |
0 |
|
|
72603 |
48416351 |
1 |
SO4N5C18H29 |
AB4C5D18E29 |
-161.0 |
4.43 |
-9.27 |
-0.2 |
0 |
|
|
72604 |
48416352 |
1 |
N3O4C19H25 |
A3B4C19D25 |
-119.96 |
6.47 |
-8.56 |
-0.02 |
0 |
|
|
72605 |
48416353 |
1 |
SO4N5C18H23 |
AB4C5D18E23 |
-110.65 |
12.96 |
-9.56 |
-1.18 |
0 |
|
|
72606 |
48416354 |
1 |
SN4O4C16H20 |
AB4C4D16E20 |
-66.37 |
9.43 |
-8.86 |
-1.35 |
0 |
|
|
72607 |
48416355 |
2 |
N2O2C10H13 |
A2B2C10D13 |
-152.65 |
6.26 |
-9.02 |
-0.65 |
0 |
|
|
72608 |
48416356 |
1 |
SN4O4C16H22 |
AB4C4D16E22 |
-137.58 |
7.83 |
-9.54 |
-0.6 |
0 |
|
|
72609 |
48416357 |
1 |
O3N4C22H26 |
A3B4C22D26 |
-97.2 |
2.54 |
-8.86 |
-0.51 |
0 |
|
|
72610 |
48416358 |
1 |
ClSN4O4C17H23 |
ABC4D4E17F23 |
-152.63 |
5.11 |
-9.48 |
-0.87 |
0 |
|
|
72611 |
48416359 |
1 |
SN4O4C19H28 |
AB4C4D19E28 |
-156.69 |
5.41 |
-9.65 |
-0.78 |
0 |
|
|
72612 |
48416360 |
1 |
FO3N4C17H21 |
AB3C4D17E21 |
-154.11 |
3.04 |
-9.46 |
-0.66 |
0 |
|
|
72613 |
48416361 |
1 |
SO2N6C19H24 |
AB2C6D19E24 |
-25.27 |
4.59 |
-8.61 |
-0.59 |
0 |
|
|
72614 |
48416362 |
1 |
SO2N6C15H24 |
AB2C6D15E24 |
-55.69 |
8.44 |
-8.37 |
-0.07 |
0 |
|
|
72615 |
48416363 |
1 |
SO3N6C19H24 |
AB3C6D19E24 |
-55.1 |
4.51 |
-8.4 |
-0.37 |
0 |
|
|
72616 |
48416364 |
1 |
O2S2N6C17H22 |
A2B2C6D17E22 |
-16.37 |
3.88 |
-8.9 |
-1.19 |
0 |
|
|
72617 |
48416365 |
1 |
O2S2N4C17H20 |
A2B2C4D17E20 |
-28.23 |
1.09 |
-8.98 |
-1.1 |
0 |
|
|
72618 |
48416366 |
1 |
SN3O4C13H21 |
AB3C4D13E21 |
-181.27 |
4.67 |
-9.52 |
0.37 |
0 |
|
|
72619 |
48416367 |
1 |
O2N4C19H24 |
A2B4C19D24 |
-53.48 |
4.74 |
-8.32 |
0.22 |
0 |
|
|
72620 |
48416368 |
1 |
O3N4C19H26 |
A3B4C19D26 |
-122.3 |
6.68 |
-9.22 |
-0.27 |
0 |
|
|
72621 |
48416369 |
1 |
ClN3O3C17H18 |
AB3C3D17E18 |
-84.0 |
2.44 |
-9.38 |
-1.08 |
0 |
|
|
72622 |
48416370 |
1 |
N5O6C18H21 |
A5B6C18D21 |
-139.93 |
8.43 |
-9.3 |
-1.4 |
0 |
|
|
72623 |
48416371 |
1 |
N4O4C19H32 |
A4B4C19D32 |
-216.23 |
4.85 |
-9.37 |
0.73 |
0 |
|
|
72624 |
48416372 |
1 |
SO3N4C14H22 |
AB3C4D14E22 |
-136.19 |
7.68 |
-9.12 |
-0.08 |
0 |
|
|
72625 |
48416373 |
1 |
O3N5C20H23 |
A3B5C20D23 |
-55.4 |
8.63 |
-9.2 |
-0.39 |
0 |
|
|
72626 |
48416374 |
1 |
N4O6C19H26 |
A4B6C19D26 |
-217.03 |
4.97 |
-9.28 |
-0.68 |
0 |
|
|
72627 |
48416375 |
2 |
ON3C11H12 |
AB3C11D12 |
16.98 |
2.57 |
-9.32 |
-0.68 |
0 |
|
|
72628 |
48416376 |
1 |
O2S2N4C17H20 |
A2B2C4D17E20 |
-30.88 |
7.37 |
-8.87 |
-1.02 |
0 |
|
|
72629 |
48416377 |
1 |
O3N6C17H20 |
A3B6C17D20 |
-53.66 |
3.72 |
-9.35 |
-1.18 |
0 |
|
|
72630 |
48416378 |
1 |
SO3N5C19H23 |
AB3C5D19E23 |
-102.63 |
9.86 |
-8.77 |
-1.13 |
0 |
|
|
72631 |
48416379 |
1 |
N4O5C21H30 |
A4B5C21D30 |
-195.11 |
3.77 |
-8.45 |
-0.13 |
0 |
|
|
72632 |
48416380 |
1 |
BrO3N4C17H21 |
AB3C4D17E21 |
-103.68 |
2.13 |
-9.45 |
-0.62 |
0 |
|
|
72633 |
48416381 |
1 |
BrN4O4C15H19 |
AB4C4D15E19 |
-126.76 |
3.99 |
-9.5 |
-0.84 |
0 |
|
|
72634 |
48416382 |
1 |
N4O4C19H26 |
A4B4C19D26 |
-154.78 |
6.6 |
-9.13 |
-0.16 |
0 |
|
|
72635 |
48416383 |
1 |
O3N4C18H24 |
A3B4C18D24 |
-115.42 |
4.98 |
-9.44 |
-0.17 |
0 |
|
|
72636 |
48416384 |
1 |
N5O6C19H23 |
A5B6C19D23 |
-149.82 |
6.99 |
-9.61 |
-1.64 |
0 |
|
|
72637 |
48416385 |
1 |
O4N5C21H27 |
A4B5C21D27 |
-156.51 |
8.29 |
-9.1 |
-0.58 |
0 |
|
|
72638 |
48416386 |
1 |
O2N3C20H29 |
A2B3C20D29 |
-96.23 |
7.62 |
-8.86 |
0.59 |
0 |
|
|
72639 |
48416387 |
1 |
O3N4C20H26 |
A3B4C20D26 |
-119.47 |
2.47 |
-8.62 |
0.01 |
0 |
|
|
72640 |
48416388 |
2 |
N2O2C9H12 |
A2B2C9D12 |
-160.48 |
5.03 |
-9.3 |
-0.38 |
0 |
|
|
72641 |
48416389 |
1 |
ClO3N5C19H22 |
AB3C5D19E22 |
-56.69 |
3.26 |
-9.46 |
-1.0 |
0 |
|
|
72642 |
48416390 |
1 |
FO3N5C19H22 |
AB3C5D19E22 |
-92.81 |
7.84 |
-9.63 |
-0.9 |
0 |
|
|
72643 |
48416392 |
1 |
ClN3O3C22H24 |
AB3C3D22E24 |
-86.12 |
6.58 |
-9.24 |
-0.62 |
0 |
|
|
72644 |
48416393 |
1 |
N3O3C17H23 |
A3B3C17D23 |
-106.46 |
8.1 |
-9.24 |
0.12 |
0 |
|
|
72645 |
48416394 |
1 |
SO3N4C13H20 |
AB3C4D13E20 |
-134.57 |
3.94 |
-9.27 |
-0.58 |
0 |
|
|
72646 |
48416395 |
1 |
O3N5C19H25 |
A3B5C19D25 |
-109.14 |
9.14 |
-9.47 |
-1.06 |
0 |
|
|
72647 |
48416396 |
1 |
FSO2N3C18H20 |
ABC2D3E18F20 |
-103.22 |
6.4 |
-8.93 |
-1.02 |
0 |
|
|
72648 |
48416397 |
1 |
F2N3O3C17H21 |
A2B3C3D17E21 |
-218.05 |
9.17 |
-9.07 |
0.05 |
0 |
|
|
72649 |
48416398 |
1 |
O2S2N4C17H20 |
A2B2C4D17E20 |
-30.9 |
7.08 |
-9.12 |
-1.07 |
0 |
|
|
72650 |
48416399 |
1 |
ClSO2N4C19H21 |
ABC2D4E19F21 |
-43.73 |
5.99 |
-9.3 |
-1.25 |
0 |
|
|
72651 |
48416400 |
1 |
SO2N4C18H20 |
AB2C4D18E20 |
-22.68 |
3.11 |
-9.15 |
-1.11 |
0 |