List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
379409 |
134419358 |
1 |
N2O2C13H20 |
A2B2C13D20 |
-88.39 |
2.93 |
-10.13 |
-0.36 |
0 |
|
|
379410 |
134419359 |
1 |
NO2C15H31 |
AB2C15D31 |
-161.91 |
2.42 |
-9.89 |
0.89 |
0 |
|
|
379411 |
134419361 |
1 |
O2N5C8H17 |
A2B5C8D17 |
-41.29 |
2.04 |
-9.41 |
-0.35 |
0 |
|
|
379412 |
134419362 |
1 |
FN6C23H23 |
AB6C23D23 |
78.52 |
6.1 |
-8.51 |
-0.84 |
0 |
|
|
379413 |
134419364 |
1 |
NO2C15H19 |
AB2C15D19 |
-77.84 |
2.45 |
-10.01 |
-1.31 |
0 |
|
|
379414 |
134419365 |
1 |
NO3C10H19 |
AB3C10D19 |
-157.71 |
2.0 |
-10.05 |
-0.21 |
0 |
|
|
379415 |
134419367 |
1 |
N2O7C19H32 |
A2B7C19D32 |
-311.61 |
6.81 |
-9.8 |
-0.57 |
0 |
|
|
379417 |
134419371 |
1 |
ClN2O10C38H45 |
AB2C10D38E45 |
-350.54 |
4.83 |
-9.35 |
-0.63 |
0 |
|
|
379418 |
134419377 |
1 |
ON5C19H23 |
AB5C19D23 |
45.71 |
7.34 |
-9.08 |
-0.69 |
0 |
|
|
379419 |
134419388 |
1 |
SO2N4C20H22 |
AB2C4D20E22 |
-2.88 |
3.98 |
-9.69 |
-1.35 |
0 |
|
|
379420 |
134419396 |
2 |
OSC16H18 |
ABC16D18 |
42.09 |
3.29 |
-8.26 |
-1.27 |
0 |
|
|
379421 |
134419397 |
1 |
O5C20H24 |
A5B20C24 |
-202.16 |
2.99 |
-9.26 |
-0.02 |
0 |
|
|
379422 |
134419401 |
1 |
O3C14H22 |
A3B14C22 |
-148.84 |
1.96 |
-10.15 |
1.8 |
0 |
|
|
379423 |
134419402 |
4 |
OC6H10 |
AB6C10 |
-234.25 |
4.43 |
-9.94 |
0.61 |
0 |
|
|
379424 |
134419403 |
2 |
O2C9H14 |
A2B9C14 |
-210.8 |
4.13 |
-10.03 |
0.62 |
0 |
|
|
379425 |
134419406 |
1 |
NO3C11H15 |
AB3C11D15 |
-121.3 |
6.25 |
-10.73 |
-1.2 |
0 |
|
|
379426 |
134419407 |
1 |
N3O5C13H25 |
A3B5C13D25 |
-256.12 |
7.29 |
-9.74 |
0.3 |
0 |
|
|
379427 |
134419409 |
2 |
O3C12H22 |
A3B12C22 |
-356.15 |
2.84 |
-10.01 |
1.33 |
0 |
|
|
379428 |
134419410 |
1 |
O3C12H22 |
A3B12C22 |
-169.14 |
3.42 |
-9.83 |
0.13 |
0 |
|
|
379429 |
134419412 |
1 |
NO2C11H21 |
AB2C11D21 |
-129.5 |
3.36 |
-9.49 |
1.95 |
0 |
|
|
379430 |
134419415 |
2 |
NO2C7H11 |
AB2C7D11 |
-161.99 |
2.7 |
-9.46 |
-0.17 |
0 |
|
|
379431 |
134419416 |
2 |
NOC6H10 |
ABC6D10 |
-96.88 |
2.62 |
-9.29 |
0.55 |
0 |
|
|
379432 |
134419423 |
1 |
O3C11H20 |
A3B11C20 |
-165.23 |
3.75 |
-10.21 |
-0.19 |
0 |
|
|
379433 |
134419432 |
1 |
FO4C49H49 |
AB4C49D49 |
-137.28 |
2.56 |
-8.24 |
-1.0 |
0 |
|
|
379434 |
134419433 |
2 |
FO2H18C20 |
AB2C18D20 |
-169.38 |
4.41 |
-8.49 |
-0.7 |
0 |
|
|
379435 |
134419437 |
1 |
F3O4H45C52 |
A3B4C45D52 |
-194.78 |
3.26 |
-8.65 |
-1.02 |
0 |
|
|
379436 |
134419442 |
1 |
F3O4H71C73 |
A3B4C71D73 |
-235.14 |
3.43 |
-8.1 |
-0.95 |
0 |
|
|
379437 |
134419479 |
1 |
BrO4C51H53 |
AB4C51D53 |
-100.2 |
1.92 |
-8.22 |
-0.98 |
0 |
|
|
379438 |
134419480 |
1 |
ClO4C49H49 |
AB4C49D49 |
-99.34 |
2.9 |
-8.27 |
-1.01 |
0 |
|
|
379439 |
134419487 |
1 |
F3O4H59C61 |
A3B4C59D61 |
-223.91 |
2.07 |
-8.36 |
-0.83 |
0 |
|
|
379440 |
134419488 |
1 |
F3O4H47C61 |
A3B4C47D61 |
-172.57 |
4.4 |
-8.29 |
-1.24 |
0 |
|
|
379441 |
134419489 |
1 |
O4F5H49C63 |
A4B5C49D63 |
-280.64 |
5.04 |
-8.31 |
-1.26 |
0 |
|
|
379442 |
134419492 |
1 |
F3O4H63C66 |
A3B4C63D66 |
-206.48 |
5.21 |
-8.23 |
-1.04 |
0 |
|
|
379443 |
134419498 |
1 |
F3O4H41C46 |
A3B4C41D46 |
-231.87 |
6.18 |
-8.33 |
-1.08 |
0 |
|
|
379444 |
134419505 |
1 |
O2C15H22 |
A2B15C22 |
-104.69 |
3.9 |
-9.37 |
-0.35 |
0 |
|
|
379445 |
134419506 |
2 |
NSC4H7 |
ABC4D7 |
29.47 |
4.58 |
-8.82 |
-0.86 |
0 |
|
|
379446 |
134419511 |
1 |
NO3C25H37 |
AB3C25D37 |
-148.75 |
6.38 |
-9.1 |
-0.83 |
0 |
|
|
379447 |
134419522 |
1 |
O4S4H38C41 |
A4B4C38D41 |
162.94 |
4.18 |
-8.28 |
-1.17 |
0 |
|
|
379448 |
134419524 |
1 |
O4C15H20 |
A4B15C20 |
-163.26 |
3.08 |
-10.27 |
-1.2 |
0 |
|
|
379449 |
134419526 |
2 |
OSC13H19 |
ABC13D19 |
-91.4 |
4.34 |
-8.72 |
-0.67 |
0 |
|
|
379450 |
134419533 |
1 |
O3N5C21H31 |
A3B5C21D31 |
-109.33 |
2.12 |
-8.91 |
-0.36 |
0 |
|
|
379451 |
134419534 |
1 |
N8O9C41H58 |
A8B9C41D58 |
-389.72 |
6.88 |
-8.86 |
-0.89 |
0 |
|
|
379452 |
134419536 |
1 |
OSC13H18 |
ABC13D18 |
-47.38 |
1.57 |
-8.93 |
-0.59 |
0 |
|
|
379453 |
134419537 |
1 |
OSC15H24 |
ABC15D24 |
-70.41 |
2.56 |
-8.95 |
0.17 |
0 |
|
|
379454 |
134419538 |
1 |
O2C15H24 |
A2B15C24 |
-116.23 |
2.82 |
-9.3 |
0.27 |
0 |
|
|
379455 |
134419539 |
1 |
O9N10C32H44 |
A9B10C32D44 |
-296.34 |
7.84 |
-9.19 |
-1.51 |
0 |
|
|
379456 |
134419543 |
2 |
OSC14H14 |
ABC14D14 |
-40.3 |
3.54 |
-8.55 |
-0.97 |
0 |
|
|
379457 |
134419544 |
1 |
OSC13H28 |
ABC13D28 |
-63.49 |
3.73 |
-6.68 |
1.2 |
0 |
|
|
379458 |
134419545 |
1 |
N2C11H18 |
A2B11C18 |
-2.3 |
2.8 |
-8.58 |
0.32 |
0 |
|
|
379459 |
134420438 |
4 |
OH15C27 |
AB15C27 |
339.32 |
3.44 |
-8.29 |
-1.18 |
0 |
|
|
379460 |
134426573 |
1 |
ON2C15H18 |
AB2C15D18 |
-7.22 |
5.32 |
-8.74 |
0.21 |
0 |
|
|
379461 |
134433960 |
1 |
SO2C8H14 |
AB2C8D14 |
-106.97 |
2.71 |
-8.66 |
0.65 |
0 |
|
|
379462 |
134434025 |
1 |
BrFNO2S2C19H21 |
ABCD2E2F19G21 |
-63.33 |
7.47 |
-8.48 |
-0.52 |
0 |
|
|
379463 |
134434042 |
1 |
NOH13C24 |
ABC13D24 |
104.76 |
0.86 |
-8.35 |
-0.97 |
0 |
|
|
379464 |
134434095 |
1 |
SN5H29C53 |
AB5C29D53 |
314.31 |
7.2 |
-8.01 |
-1.46 |
0 |
|
|
379465 |
134434099 |
1 |
N2H30C53 |
A2B30C53 |
268.62 |
3.1 |
-7.88 |
-0.9 |
0 |
|
|
379466 |
134434211 |
1 |
N2S2O4F7C27H27 |
A2B2C4D7E27F27 |
-461.74 |
7.02 |
-9.13 |
-1.11 |
0 |
|
|
379467 |
134434245 |
1 |
ClN2F3O3C29H34 |
AB2C3D3E29F34 |
-267.53 |
5.15 |
-9.34 |
-0.38 |
0 |
|
|
379468 |
134434266 |
1 |
SO2N5C22H23 |
AB2C5D22E23 |
23.04 |
1.84 |
-8.09 |
-0.54 |
0 |
|
|
379469 |
134434291 |
1 |
FO2S2N3H10C13 |
AB2C2D3E10F13 |
-43.6 |
4.52 |
-9.46 |
-1.64 |
0 |
|
|
379470 |
134434312 |
1 |
SO2N4C20H22 |
AB2C4D20E22 |
-22.08 |
4.84 |
-8.63 |
-1.12 |
0 |
|
|
379471 |
134434359 |
1 |
ON2C14H20 |
AB2C14D20 |
-37.91 |
4.57 |
-8.76 |
0.09 |
0 |
|
|
379472 |
134434361 |
1 |
ON2C15H22 |
AB2C15D22 |
-45.63 |
3.99 |
-8.58 |
0.12 |
0 |
|
|
379473 |
134434477 |
1 |
OF2N4C20H30 |
AB2C4D20E30 |
-126.13 |
4.49 |
-8.54 |
-0.79 |
0 |
|
|
379474 |
134434631 |
1 |
ClON3C14H20 |
ABC3D14E20 |
-33.8 |
2.83 |
-8.52 |
-0.91 |
0 |
|
|
379475 |
134434794 |
1 |
O3N6C25H30 |
A3B6C25D30 |
-29.14 |
8.39 |
-8.36 |
-0.92 |
0 |
|
|
379476 |
134434815 |
1 |
ClON6C18H21 |
ABC6D18E21 |
53.08 |
8.47 |
-8.36 |
-0.92 |
0 |
|
|
379477 |
134435030 |
2 |
NOC7H13 |
ABC7D13 |
-118.63 |
2.01 |
-8.73 |
0.86 |
0 |
|
|
379478 |
134435037 |
1 |
FO3N6H23C25 |
AB3C6D23E25 |
-3.79 |
5.39 |
-8.97 |
-1.08 |
0 |
|
|
379479 |
134435038 |
2 |
NOC9H14 |
ABC9D14 |
-110.45 |
3.28 |
-8.65 |
0.34 |
0 |
|
|
379480 |
134435261 |
1 |
ON3C17H27 |
AB3C17D27 |
-39.21 |
3.45 |
-8.56 |
-0.12 |
0 |
|
|
379481 |
134435272 |
1 |
ON3C13H27 |
AB3C13D27 |
-85.89 |
3.69 |
-8.7 |
1.04 |
0 |
|
|
379482 |
134435567 |
1 |
N3C16H23 |
A3B16C23 |
26.96 |
5.29 |
-8.33 |
-0.02 |
0 |
|
|
379483 |
134435612 |
1 |
O2N4C17H34 |
A2B4C17D34 |
-129.72 |
1.38 |
-8.6 |
0.83 |
0 |
|
|
379484 |
134435866 |
1 |
ON3C13H25 |
AB3C13D25 |
-54.42 |
3.27 |
-8.72 |
0.94 |
0 |