List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
66351 |
46504413 |
1 |
N3O6C25H25 |
A3B6C25D25 |
-162.0 |
3.95 |
-8.11 |
-1.25 |
0 |
|
|
66352 |
46504415 |
1 |
N3O6H23C24 |
A3B6C23D24 |
-149.67 |
4.86 |
-8.13 |
-1.27 |
0 |
|
|
66353 |
46504424 |
1 |
N5O7C18H21 |
A5B7C18D21 |
-76.94 |
11.95 |
-9.22 |
-1.79 |
0 |
|
|
66354 |
46504425 |
1 |
F3O4N6C20H21 |
A3B4C6D20E21 |
-100.94 |
7.38 |
-9.11 |
-1.58 |
0 |
|
|
66355 |
46504426 |
1 |
F3O4N6C19H19 |
A3B4C6D19E19 |
-111.23 |
11.84 |
-9.43 |
-1.77 |
0 |
|
|
66356 |
46504428 |
1 |
ClO5N6C21H25 |
AB5C6D21E25 |
-5.97 |
9.33 |
-9.02 |
-1.53 |
0 |
|
|
66357 |
46504430 |
1 |
ClO5N6C20H23 |
AB5C6D20E23 |
-1.13 |
10.7 |
-9.11 |
-1.67 |
0 |
|
|
66358 |
46504438 |
1 |
N2O5H22C25 |
A2B5C22D25 |
-117.12 |
7.07 |
-8.82 |
-1.44 |
0 |
|
|
66359 |
46504439 |
1 |
N2O5H22C25 |
A2B5C22D25 |
-108.87 |
3.59 |
-8.74 |
-1.7 |
0 |
|
|
66360 |
46504440 |
1 |
N3O6C24H25 |
A3B6C24D25 |
-196.3 |
1.69 |
-9.06 |
-1.79 |
0 |
|
|
66361 |
46504443 |
1 |
N3O6H23C26 |
A3B6C23D26 |
-137.86 |
3.64 |
-9.03 |
-1.75 |
0 |
|
|
66362 |
46504447 |
1 |
N2O7H24C27 |
A2B7C24D27 |
-173.75 |
2.91 |
-8.33 |
-0.63 |
0 |
|
|
66363 |
46504448 |
1 |
N2O7H22C26 |
A2B7C22D26 |
-161.22 |
2.68 |
-8.58 |
-0.32 |
0 |
|
|
66364 |
46504450 |
1 |
N3O4C29H31 |
A3B4C29D31 |
-113.67 |
6.84 |
-8.9 |
-0.29 |
0 |
|
|
66365 |
46504452 |
4 |
NOC7H7 |
ABC7D7 |
-102.13 |
6.91 |
-9.11 |
-0.39 |
0 |
|
|
66366 |
46504454 |
1 |
N3O5C29H31 |
A3B5C29D31 |
-151.0 |
2.18 |
-8.32 |
-0.23 |
0 |
|
|
66367 |
46504455 |
1 |
N3O5C29H31 |
A3B5C29D31 |
-134.75 |
5.42 |
-9.04 |
-0.23 |
0 |
|
|
66368 |
46504456 |
1 |
N3O5C26H33 |
A3B5C26D33 |
-204.68 |
5.64 |
-8.15 |
0.03 |
0 |
|
|
66369 |
46504458 |
1 |
N2O6H26C27 |
A2B6C26D27 |
-139.11 |
4.24 |
-8.21 |
-0.61 |
0 |
|
|
66370 |
46504461 |
2 |
NO2C15H22 |
AB2C15D22 |
-191.01 |
2.33 |
-8.47 |
-0.19 |
0 |
|
|
66371 |
46504462 |
1 |
N2O5C31H46 |
A2B5C31D46 |
-235.61 |
4.25 |
-8.59 |
0.31 |
0 |
|
|
66372 |
46504463 |
1 |
SN3O4C28H33 |
AB3C4D28E33 |
-105.35 |
3.71 |
-9.14 |
-0.42 |
0 |
|
|
66373 |
46504464 |
1 |
SN2O4C36H50 |
AB2C4D36E50 |
-175.06 |
1.6 |
-8.5 |
-0.06 |
0 |
|
|
66374 |
46504466 |
1 |
SN3O4C29H33 |
AB3C4D29E33 |
-90.69 |
2.36 |
-8.23 |
0.0 |
0 |
|
|
66375 |
46504469 |
1 |
N3O7C22H29 |
A3B7C22D29 |
-206.76 |
4.87 |
-9.02 |
-1.27 |
0 |
|
|
66376 |
46504470 |
4 |
NOC5H5 |
ABC5D5 |
-8.93 |
4.94 |
-8.14 |
-1.91 |
0 |
|
|
66377 |
46504471 |
1 |
O2N3C24H25 |
A2B3C24D25 |
-11.11 |
2.68 |
-8.06 |
-0.44 |
0 |
|
|
66378 |
46504473 |
1 |
SO2N3C21H21 |
AB2C3D21E21 |
2.05 |
4.01 |
-8.12 |
-1.16 |
0 |
|
|
66379 |
46504478 |
1 |
OF2N4C23H24 |
AB2C4D23E24 |
-71.74 |
4.08 |
-8.07 |
-0.94 |
0 |
|
|
66380 |
46504479 |
1 |
O3N4C25H30 |
A3B4C25D30 |
-54.07 |
6.54 |
-7.93 |
-0.6 |
0 |
|
|
66381 |
46504480 |
1 |
FON4C23H25 |
ABC4D23E25 |
-25.38 |
1.6 |
-8.07 |
-0.71 |
0 |
|
|
66382 |
46504481 |
1 |
O3N4C26H28 |
A3B4C26D28 |
-29.99 |
3.54 |
-8.01 |
-0.92 |
0 |
|
|
66383 |
46504482 |
1 |
ON4C26H30 |
AB4C26D30 |
25.05 |
2.61 |
-8.0 |
-0.38 |
0 |
|
|
66384 |
46504484 |
1 |
O3N6C27H28 |
A3B6C27D28 |
-11.98 |
3.78 |
-8.21 |
-0.56 |
0 |
|
|
66385 |
46504486 |
1 |
O3N6C27H28 |
A3B6C27D28 |
-1.18 |
3.39 |
-8.07 |
-0.46 |
0 |
|
|
66386 |
46504487 |
1 |
O4N6C31H36 |
A4B6C31D36 |
-61.67 |
4.17 |
-8.33 |
-0.64 |
0 |
|
|
66387 |
46504488 |
1 |
ON6C28H28 |
AB6C28D28 |
78.04 |
5.81 |
-8.17 |
-0.53 |
0 |
|
|
66388 |
46504489 |
2 |
ON3C16H18 |
AB3C16D18 |
21.64 |
5.86 |
-7.99 |
-0.7 |
0 |
|
|
66389 |
46504490 |
1 |
O3N6C30H32 |
A3B6C30D32 |
1.14 |
3.09 |
-8.11 |
-0.5 |
0 |
|
|
66390 |
46504491 |
1 |
S2N5O5C28H35 |
A2B5C5D28E35 |
-130.81 |
5.91 |
-8.26 |
-1.41 |
0 |
|
|
66391 |
46504492 |
1 |
S2O5N6H28C29 |
A2B5C6D28E29 |
-75.31 |
2.63 |
-8.35 |
-1.62 |
0 |
|
|
66392 |
46504493 |
1 |
S2N5O6C27H29 |
A2B5C6D27E29 |
-139.83 |
5.98 |
-8.45 |
-1.47 |
0 |
|
|
66393 |
46504497 |
1 |
S2N5O6H31C32 |
A2B5C6D31E32 |
-108.76 |
5.4 |
-8.07 |
-1.55 |
0 |
|
|
66394 |
46504498 |
1 |
S2N5O7C28H31 |
A2B5C7D28E31 |
-182.49 |
2.22 |
-8.49 |
-1.18 |
0 |
|
|
66395 |
46504499 |
1 |
S2N5O8C29H33 |
A2B5C8D29E33 |
-216.01 |
5.2 |
-8.04 |
-1.51 |
0 |
|
|
66396 |
46504502 |
1 |
S2N5O5C28H31 |
A2B5C5D28E31 |
-102.95 |
2.42 |
-8.01 |
-1.31 |
0 |
|
|
66397 |
46504503 |
1 |
S2N5O5C26H33 |
A2B5C5D26E33 |
-141.48 |
2.52 |
-7.99 |
-1.26 |
0 |
|
|
66398 |
46504504 |
1 |
S2O5N6C25H32 |
A2B5C6D25E32 |
-123.38 |
3.47 |
-7.96 |
-1.32 |
0 |
|
|
66399 |
46504505 |
1 |
FS2O5N6C30H33 |
AB2C5D6E30F33 |
-138.82 |
4.46 |
-8.86 |
-1.32 |
0 |
|
|
66400 |
46504507 |
1 |
ClS2O5N6C30H33 |
AB2C5D6E30F33 |
-106.54 |
4.23 |
-8.74 |
-1.44 |
0 |
|
|
66401 |
46504508 |
1 |
S2O5N6C30H34 |
A2B5C6D30E34 |
-95.21 |
6.54 |
-8.11 |
-1.37 |
0 |
|
|
66402 |
46504509 |
1 |
S2N6O6C27H36 |
A2B6C6D27E36 |
-172.1 |
1.84 |
-8.06 |
-1.48 |
0 |
|
|
66403 |
46504510 |
1 |
S2N5O5C26H33 |
A2B5C5D26E33 |
-141.25 |
5.34 |
-8.13 |
-1.18 |
0 |
|
|
66404 |
46504517 |
1 |
S2N5O5C26H35 |
A2B5C5D26E35 |
-148.62 |
4.9 |
-7.89 |
-1.19 |
0 |
|
|
66405 |
46504518 |
1 |
S2O5N6C31H36 |
A2B5C6D31E36 |
-99.15 |
6.56 |
-8.69 |
-1.41 |
0 |
|
|
66406 |
46504519 |
1 |
S2O5N6C27H36 |
A2B5C6D27E36 |
-135.16 |
3.42 |
-8.84 |
-1.34 |
0 |
|
|
66407 |
46504520 |
1 |
S2O5N7C29H33 |
A2B5C7D29E33 |
-87.31 |
2.62 |
-8.68 |
-1.19 |
0 |
|
|
66408 |
46504521 |
1 |
S2O5N6C28H32 |
A2B5C6D28E32 |
-93.97 |
6.17 |
-8.12 |
-1.33 |
0 |
|
|
66409 |
46504523 |
1 |
S2N5O5C27H35 |
A2B5C5D27E35 |
-152.48 |
1.81 |
-7.95 |
-1.28 |
0 |
|
|
66410 |
46504524 |
1 |
FS2O5N6C30H33 |
AB2C5D6E30F33 |
-143.68 |
5.14 |
-8.08 |
-1.49 |
0 |
|
|
66411 |
46504528 |
1 |
S2O5N6C32H40 |
A2B5C6D32E40 |
-120.3 |
6.21 |
-8.04 |
-1.37 |
0 |
|
|
66412 |
46504529 |
1 |
S2O5N6C29H40 |
A2B5C6D29E40 |
-153.23 |
3.27 |
-8.63 |
-1.12 |
0 |
|
|
66413 |
46504532 |
1 |
S2N5O7C20H27 |
A2B5C7D20E27 |
-244.6 |
8.76 |
-9.35 |
-1.55 |
0 |
|
|
66414 |
46504533 |
1 |
S2N5O7C25H29 |
A2B5C7D25E29 |
-200.46 |
2.02 |
-8.71 |
-1.43 |
0 |
|
|
66415 |
46504537 |
1 |
ClN3O5C31H34 |
AB3C5D31E34 |
-143.34 |
1.18 |
-8.53 |
-0.78 |
0 |
|
|
66416 |
46504538 |
1 |
N3O6C32H37 |
A3B6C32D37 |
-176.64 |
2.52 |
-8.16 |
-0.61 |
0 |
|
|
66417 |
46504541 |
1 |
N3O6C32H35 |
A3B6C32D35 |
-168.82 |
4.22 |
-8.5 |
-0.82 |
0 |
|
|
66418 |
46504543 |
1 |
ClN4O4C34H39 |
AB4C4D34E39 |
-100.11 |
9.96 |
-8.24 |
-0.6 |
0 |
|
|
66419 |
46504544 |
1 |
N4O7C31H34 |
A4B7C31D34 |
-136.7 |
8.54 |
-8.78 |
-1.27 |
0 |
|
|
66420 |
46504545 |
1 |
FN3O5C31H32 |
AB3C5D31E32 |
-189.0 |
1.85 |
-9.08 |
-0.88 |
0 |
|
|
66421 |
46504546 |
1 |
FN3O5H34C36 |
AB3C5D34E36 |
-128.8 |
7.43 |
-8.78 |
-0.46 |
0 |
|
|
66422 |
46504547 |
1 |
FN3O3C34H40 |
AB3C3D34E40 |
-107.34 |
9.32 |
-8.89 |
-0.56 |
0 |
|
|
66423 |
46504548 |
1 |
FO3N4C33H39 |
AB3C4D33E39 |
-105.42 |
9.7 |
-8.9 |
-0.35 |
0 |
|
|
66424 |
46504549 |
1 |
S2F3N3O4H12C16 |
A2B3C3D4E12F16 |
-225.35 |
4.37 |
-9.3 |
-2.17 |
0 |
|
|
66425 |
46504550 |
1 |
FSN4O4H13C15 |
ABC4D4E13F15 |
-57.82 |
3.07 |
-9.19 |
-2.06 |
0 |
|
|
66426 |
46504551 |
1 |
FSN4O4H13C15 |
ABC4D4E13F15 |
-62.44 |
3.19 |
-9.28 |
-2.11 |
0 |
|
|
66427 |
46504553 |
1 |
ClS2O3N4H13C15 |
AB2C3D4E13F15 |
-24.03 |
5.62 |
-8.95 |
-2.11 |
0 |
|
|
66428 |
46504556 |
1 |
S2O3N5C21H25 |
A2B3C5D21E25 |
-23.51 |
2.27 |
-8.85 |
-2.02 |
0 |
|
|
66429 |
46504558 |
1 |
BrS2O3N4H13C15 |
AB2C3D4E13F15 |
-12.53 |
6.91 |
-9.03 |
-2.13 |
0 |
|
|
66430 |
46504559 |
1 |
O3S3N4C16H16 |
A3B3C4D16E16 |
-15.4 |
5.9 |
-8.78 |
-2.11 |
0 |
|
|
66431 |
46504560 |
1 |
S2O3N5C19H27 |
A2B3C5D19E27 |
-57.93 |
10.13 |
-8.89 |
-1.92 |
0 |
|
|
66432 |
46504561 |
1 |
F2S2O3N4H12C15 |
A2B2C3D4E12F15 |
-103.35 |
7.34 |
-9.33 |
-2.08 |
0 |
|
|
66433 |
46504563 |
1 |
BrN4O5C27H35 |
AB4C5D27E35 |
-179.61 |
4.49 |
-8.54 |
-0.46 |
0 |
|
|
66434 |
46504565 |
1 |
BrN5O5C31H36 |
AB5C5D31E36 |
-132.53 |
5.96 |
-8.4 |
-0.5 |
0 |
|
|
66435 |
46504569 |
1 |
FN3O6C31H34 |
AB3C6D31E34 |
-195.37 |
9.47 |
-8.49 |
-0.28 |
0 |
|
|
66436 |
46504572 |
1 |
FN3O6C31H34 |
AB3C6D31E34 |
-198.42 |
6.38 |
-8.64 |
-0.55 |
0 |
|
|
66437 |
46504573 |
1 |
N3O6C33H41 |
A3B6C33D41 |
-167.53 |
2.83 |
-8.72 |
-0.52 |
0 |
|
|
66438 |
46504574 |
1 |
N3O6C33H41 |
A3B6C33D41 |
-179.1 |
10.29 |
-8.08 |
-0.26 |
0 |
|
|
66439 |
46504575 |
1 |
ClN4O6C34H41 |
AB4C6D34E41 |
-167.77 |
6.46 |
-8.31 |
-0.33 |
0 |
|
|
66440 |
46504576 |
1 |
N3O6C31H43 |
A3B6C31D43 |
-205.26 |
8.84 |
-8.45 |
-0.3 |
0 |
|
|
66441 |
46504577 |
1 |
N3O6C31H43 |
A3B6C31D43 |
-209.16 |
2.04 |
-8.43 |
-0.5 |
0 |
|
|
66442 |
46504578 |
2 |
N2O3C15H21 |
A2B3C15D21 |
-196.49 |
3.05 |
-8.29 |
-0.47 |
0 |
|
|
66443 |
46504585 |
1 |
ClN2O7C29H31 |
AB2C7D29E31 |
-215.36 |
7.82 |
-8.34 |
-0.21 |
0 |
|
|
66444 |
46504586 |
1 |
N3O7C33H37 |
A3B7C33D37 |
-191.53 |
5.73 |
-8.32 |
-0.2 |
0 |
|
|
66445 |
46504587 |
1 |
N4O6C25H30 |
A4B6C25D30 |
-191.4 |
2.86 |
-8.77 |
-0.51 |
0 |
|
|
66446 |
46504588 |
1 |
ClO4N5C31H36 |
AB4C5D31E36 |
-82.31 |
9.64 |
-8.29 |
-0.56 |
0 |
|
|
66447 |
46504589 |
1 |
ClO3N5H14C21 |
AB3C5D14E21 |
4.29 |
5.5 |
-9.12 |
-1.84 |
0 |
|
|
66448 |
46504590 |
1 |
F3O3N5H14C22 |
A3B3C5D14E22 |
-148.03 |
4.75 |
-9.25 |
-1.87 |
0 |
|
|
66449 |
46504591 |
1 |
O3N5C21H21 |
A3B5C21D21 |
-33.86 |
5.17 |
-8.98 |
-1.69 |
0 |
|
|
66450 |
46504593 |
1 |
ClFO3N5H13C21 |
ABC3D5E13F21 |
-40.88 |
6.55 |
-9.12 |
-1.88 |
0 |