List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
126436 |
50965003 |
1 |
ON6C18H22 |
AB6C18D22 |
46.72 |
4.37 |
-8.99 |
-0.49 |
0 |
|
|
126437 |
50965022 |
1 |
N2O4C21H24 |
A2B4C21D24 |
-80.99 |
0.94 |
-8.62 |
-0.34 |
0 |
|
|
126438 |
50965023 |
1 |
N3O3C20H29 |
A3B3C20D29 |
-121.52 |
4.77 |
-8.84 |
-0.1 |
0 |
|
|
126439 |
50965024 |
1 |
N6C17H20 |
A6B17C20 |
95.87 |
2.33 |
-9.58 |
-0.89 |
0 |
|
|
126440 |
50965039 |
1 |
OF3N3H10C12 |
AB3C3D10E12 |
-150.62 |
3.19 |
-9.35 |
-0.79 |
0 |
|
|
126441 |
50965040 |
1 |
O3N4H18C19 |
A3B4C18D19 |
-26.09 |
5.91 |
-9.37 |
-0.7 |
0 |
|
|
126442 |
50965041 |
1 |
SN3O4C18H25 |
AB3C4D18E25 |
-152.42 |
3.67 |
-9.24 |
-0.46 |
0 |
|
|
126443 |
50965081 |
1 |
N2O2H10C11 |
A2B2C10D11 |
-30.56 |
4.26 |
-8.67 |
-0.8 |
0 |
|
|
126444 |
50965082 |
1 |
N3O3H21C22 |
A3B3C21D22 |
-53.35 |
1.17 |
-8.85 |
-0.78 |
0 |
|
|
126445 |
50965083 |
1 |
N2O3C13H20 |
A2B3C13D20 |
-118.76 |
1.53 |
-8.36 |
0.04 |
0 |
|
|
126446 |
50965084 |
1 |
N2O5C22H24 |
A2B5C22D24 |
-157.09 |
4.06 |
-8.87 |
-0.27 |
0 |
|
|
126447 |
50965171 |
1 |
SN2O2C17H20 |
AB2C2D17E20 |
-49.09 |
4.35 |
-9.37 |
-0.44 |
0 |
|
|
126448 |
50965359 |
1 |
SN4C20H24 |
AB4C20D24 |
95.6 |
6.11 |
-8.43 |
0.06 |
0 |
|
|
126449 |
50965360 |
1 |
FSN3O3C18H18 |
ABC3D3E18F18 |
-112.02 |
2.49 |
-8.66 |
-1.26 |
0 |
|
|
126450 |
50965510 |
2 |
N2C8H9 |
A2B8C9 |
75.17 |
3.27 |
-8.9 |
-0.57 |
0 |
|
|
126451 |
50965531 |
1 |
ON5C19H31 |
AB5C19D31 |
-36.04 |
3.28 |
-8.85 |
-0.13 |
0 |
|
|
126452 |
50965532 |
2 |
N2O2C10H11 |
A2B2C10D11 |
-95.49 |
2.95 |
-9.3 |
-0.17 |
0 |
|
|
126453 |
50965572 |
2 |
ON4C8H8 |
AB4C8D8 |
74.79 |
7.52 |
-8.74 |
-1.13 |
0 |
|
|
126454 |
50965582 |
1 |
ON4C13H20 |
AB4C13D20 |
-18.75 |
3.8 |
-8.88 |
0.13 |
0 |
|
|
126455 |
50965611 |
1 |
O2N3H17C20 |
A2B3C17D20 |
11.15 |
8.49 |
-9.21 |
-0.79 |
0 |
|
|
126456 |
50965612 |
2 |
NOC11H14 |
ABC11D14 |
-67.92 |
1.44 |
-8.88 |
-0.63 |
0 |
|
|
126457 |
50965613 |
1 |
OSN3C17H19 |
ABC3D17E19 |
35.57 |
5.4 |
-8.75 |
-0.25 |
0 |
|
|
126458 |
50965614 |
3 |
NOC6H9 |
ABC6D9 |
-121.75 |
2.65 |
-8.68 |
0.08 |
0 |
|
|
126459 |
50965615 |
1 |
N3O3C17H23 |
A3B3C17D23 |
-138.72 |
4.35 |
-8.72 |
0.19 |
0 |
|
|
126460 |
50965616 |
1 |
ON6C20H24 |
AB6C20D24 |
75.63 |
8.82 |
-8.81 |
-0.58 |
0 |
|
|
126461 |
50965671 |
1 |
N3C18H19 |
A3B18C19 |
82.26 |
2.59 |
-9.08 |
-0.66 |
0 |
|
|
126462 |
50965703 |
1 |
ON5C17H21 |
AB5C17D21 |
24.75 |
4.03 |
-9.34 |
-0.81 |
0 |
|
|
126463 |
50965704 |
1 |
SO2N3H19C20 |
AB2C3D19E20 |
15.34 |
6.23 |
-9.19 |
-0.92 |
0 |
|
|
126464 |
50965797 |
1 |
OSN5C14H23 |
ABC5D14E23 |
5.6 |
7.69 |
-8.89 |
-0.17 |
0 |
|
|
126465 |
50965798 |
2 |
ON3C10H10 |
AB3C10D10 |
19.52 |
4.4 |
-8.68 |
-0.93 |
0 |
|
|
126466 |
50965802 |
1 |
ON5C20H29 |
AB5C20D29 |
-13.79 |
6.93 |
-8.64 |
0.29 |
0 |
|
|
126467 |
50965803 |
1 |
SO2N4C19H28 |
AB2C4D19E28 |
-33.62 |
3.32 |
-8.37 |
0.0 |
0 |
|
|
126468 |
50966060 |
1 |
O2N5C16H23 |
A2B5C16D23 |
-3.56 |
5.39 |
-8.92 |
-0.11 |
0 |
|
|
126469 |
50966282 |
1 |
SN3O3C15H31 |
AB3C3D15E31 |
-161.54 |
1.13 |
-8.51 |
0.42 |
0 |
|
|
126470 |
50966283 |
1 |
ON5C14H21 |
AB5C14D21 |
40.8 |
4.45 |
-8.91 |
-0.02 |
0 |
|
|
126471 |
50966284 |
1 |
ON4C21H24 |
AB4C21D24 |
26.69 |
2.85 |
-9.05 |
-0.83 |
0 |
|
|
126472 |
50966285 |
1 |
OSN3C16H21 |
ABC3D16E21 |
-3.74 |
4.26 |
-8.79 |
-0.38 |
0 |
|
|
126473 |
50966286 |
1 |
O2N3H19C20 |
A2B3C19D20 |
84.47 |
5.44 |
-8.94 |
-0.9 |
0 |
|
|
126474 |
50966287 |
1 |
N3O3C22H23 |
A3B3C22D23 |
-65.25 |
5.21 |
-8.64 |
-0.17 |
0 |
|
|
126475 |
50966288 |
1 |
ON3C20H25 |
AB3C20D25 |
8.25 |
1.52 |
-8.66 |
-0.12 |
0 |
|
|
126476 |
50966289 |
1 |
O3N4C20H22 |
A3B4C20D22 |
-81.35 |
6.08 |
-8.92 |
-0.32 |
0 |
|
|
126477 |
50966290 |
1 |
ON6C20H24 |
AB6C20D24 |
61.97 |
7.5 |
-9.6 |
-0.5 |
0 |
|
|
126478 |
50966291 |
1 |
OSN2C16H20 |
ABC2D16E20 |
-10.4 |
4.49 |
-9.27 |
-0.65 |
0 |
|
|
126479 |
50966292 |
1 |
N2O3C17H18 |
A2B3C17D18 |
-89.2 |
6.43 |
-9.17 |
-0.67 |
0 |
|
|
126480 |
50966293 |
1 |
ON5H11C14 |
AB5C11D14 |
68.41 |
3.88 |
-9.33 |
-1.08 |
0 |
|
|
126481 |
50966294 |
1 |
NO2C18H23 |
AB2C18D23 |
-43.78 |
2.03 |
-8.68 |
-0.02 |
0 |
|
|
126482 |
50966295 |
2 |
N3C10H12 |
A3B10C12 |
102.28 |
2.17 |
-8.76 |
-0.72 |
0 |
|
|
126483 |
50966296 |
1 |
O3N5C18H21 |
A3B5C18D21 |
-45.59 |
4.65 |
-9.25 |
-0.95 |
0 |
|
|
126484 |
50966297 |
2 |
ON2C8H12 |
AB2C8D12 |
-49.82 |
5.43 |
-9.3 |
-0.67 |
0 |
|
|
126485 |
50966298 |
2 |
ON2C9H11 |
AB2C9D11 |
-51.19 |
4.62 |
-9.0 |
-0.3 |
0 |
|
|
126486 |
50966299 |
1 |
O2N5C18H27 |
A2B5C18D27 |
-61.2 |
6.32 |
-9.3 |
-0.12 |
0 |
|
|
126487 |
50966300 |
1 |
ON5C19H27 |
AB5C19D27 |
6.02 |
2.87 |
-9.14 |
-0.41 |
0 |
|
|
126488 |
50966301 |
1 |
N3O5C17H27 |
A3B5C17D27 |
-246.73 |
7.66 |
-8.99 |
-0.49 |
0 |
|
|
126489 |
50966302 |
1 |
ON2H12C13 |
AB2C12D13 |
49.58 |
1.92 |
-8.84 |
-0.81 |
0 |
|
|
126490 |
50966303 |
1 |
N3O3C16H17 |
A3B3C16D17 |
-57.25 |
6.85 |
-9.02 |
-0.8 |
0 |
|
|
126491 |
50966304 |
1 |
ClO2N6C16H19 |
AB2C6D16E19 |
13.36 |
5.69 |
-9.45 |
-0.61 |
0 |
|
|
126492 |
50966305 |
1 |
SO2N3C19H23 |
AB2C3D19E23 |
-27.16 |
4.97 |
-8.82 |
-0.66 |
0 |
|
|
126493 |
50966306 |
1 |
SN3O4C18H25 |
AB3C4D18E25 |
-161.0 |
4.43 |
-9.18 |
-0.27 |
0 |
|
|
126494 |
50966307 |
1 |
O2N3C18H19 |
A2B3C18D19 |
6.77 |
1.93 |
-8.65 |
-0.25 |
0 |
|
|
126495 |
50966336 |
1 |
NSO3C21H23 |
ABC3D21E23 |
-78.81 |
3.59 |
-8.79 |
-0.87 |
0 |
|
|
126496 |
50966362 |
1 |
N2O2C21H26 |
A2B2C21D26 |
-53.11 |
2.79 |
-8.15 |
-0.32 |
0 |
|
|
126497 |
50966372 |
1 |
ON4C23H26 |
AB4C23D26 |
40.99 |
3.91 |
-8.81 |
-0.57 |
0 |
|
|
126498 |
50966373 |
2 |
FNOC9H10 |
ABCD9E10 |
-146.32 |
3.07 |
-9.55 |
-0.66 |
0 |
|
|
126499 |
50966374 |
1 |
O2N3C12H19 |
A2B3C12D19 |
-78.55 |
2.2 |
-9.01 |
-0.01 |
0 |
|
|
126500 |
50966375 |
1 |
O2N7C17H19 |
A2B7C17D19 |
34.16 |
7.38 |
-9.74 |
-0.35 |
0 |
|
|
126501 |
50966376 |
1 |
O3N6C16H20 |
A3B6C16D20 |
-33.42 |
11.1 |
-9.65 |
-0.97 |
0 |
|
|
126502 |
50966377 |
1 |
N3O3C18H23 |
A3B3C18D23 |
-110.5 |
7.72 |
-8.95 |
-0.52 |
0 |
|
|
126503 |
50966498 |
1 |
ON4C20H26 |
AB4C20D26 |
11.34 |
5.32 |
-8.89 |
0.3 |
0 |
|
|
126504 |
50966624 |
1 |
ON3C12H21 |
AB3C12D21 |
-26.29 |
6.49 |
-8.47 |
0.35 |
0 |
|
|
126505 |
50966632 |
1 |
ON5H19C20 |
AB5C19D20 |
86.85 |
7.09 |
-8.78 |
-0.76 |
0 |
|
|
126506 |
50966710 |
2 |
N3C7H10 |
A3B7C10 |
70.25 |
3.19 |
-8.47 |
0.15 |
0 |
|
|
126507 |
50966777 |
5 |
NC4H5 |
AB4C5 |
72.98 |
2.84 |
-8.7 |
-0.31 |
0 |
|
|
126508 |
50966783 |
1 |
SN2O3C16H20 |
AB2C3D16E20 |
-89.47 |
7.77 |
-9.52 |
-0.28 |
0 |
|
|
126509 |
50966784 |
1 |
N4C19H22 |
A4B19C22 |
87.2 |
3.08 |
-8.64 |
-0.14 |
0 |
|
|
126510 |
50966893 |
1 |
O2N4H18C23 |
A2B4C18D23 |
8.38 |
8.0 |
-8.58 |
-0.94 |
0 |
|
|
126511 |
50967023 |
1 |
N3O4C17H21 |
A3B4C17D21 |
-156.44 |
8.15 |
-9.19 |
-0.22 |
0 |
|
|
126512 |
50967132 |
1 |
N3O5C19H23 |
A3B5C19D23 |
-142.41 |
5.51 |
-9.05 |
-0.48 |
0 |
|
|
126513 |
50967133 |
1 |
ClN2O2C20H23 |
AB2C2D20E23 |
-47.47 |
3.16 |
-8.58 |
-0.31 |
0 |
|
|
126514 |
50967134 |
1 |
N3O3H17C18 |
A3B3C17D18 |
-26.06 |
3.16 |
-8.98 |
-0.88 |
0 |
|
|
126515 |
50967135 |
1 |
N2O3C17H22 |
A2B3C17D22 |
-94.29 |
4.85 |
-8.61 |
-0.56 |
0 |
|
|
126516 |
50967136 |
1 |
ClON4C18H23 |
ABC4D18E23 |
-1.93 |
7.3 |
-9.21 |
0.0 |
0 |
|
|
126517 |
50967137 |
1 |
SN5C11H15 |
AB5C11D15 |
69.88 |
4.33 |
-9.34 |
-1.01 |
0 |
|
|
126518 |
50967138 |
1 |
OSN2C12H22 |
ABC2D12E22 |
-43.06 |
0.96 |
-8.69 |
-0.11 |
0 |
|
|
126519 |
50967139 |
1 |
N3O3C20H25 |
A3B3C20D25 |
-102.82 |
7.73 |
-8.58 |
-0.56 |
0 |
|
|
126520 |
50967140 |
1 |
ClSO2N5H12C14 |
ABC2D5E12F14 |
31.57 |
6.63 |
-9.57 |
-1.15 |
0 |
|
|
126521 |
50967141 |
1 |
O3N4C13H14 |
A3B4C13D14 |
-61.34 |
2.61 |
-9.62 |
-0.56 |
0 |
|
|
126522 |
50967142 |
1 |
SN3C12H17 |
AB3C12D17 |
69.85 |
3.68 |
-8.74 |
0.06 |
0 |
|
|
126523 |
50967143 |
1 |
ClO2N5C15H16 |
AB2C5D15E16 |
-28.49 |
8.47 |
-9.26 |
-0.9 |
0 |
|
|
126524 |
50967144 |
1 |
ClN3O3C18H20 |
AB3C3D18E20 |
-91.67 |
5.64 |
-8.34 |
-0.97 |
0 |
|
|
126525 |
50967145 |
1 |
N5C18H23 |
A5B18C23 |
78.7 |
5.65 |
-8.86 |
-0.17 |
0 |
|
|
126526 |
50967146 |
1 |
N7C12H19 |
A7B12C19 |
87.68 |
4.64 |
-9.24 |
0.17 |
0 |
|
|
126527 |
50967266 |
2 |
N4C10H11 |
A4B10C11 |
144.74 |
5.66 |
-8.96 |
-0.83 |
0 |
|
|
126528 |
50967267 |
1 |
O2N5C19H25 |
A2B5C19D25 |
-13.39 |
2.71 |
-8.48 |
-0.05 |
0 |
|
|
126529 |
50967268 |
1 |
ON5C17H19 |
AB5C17D19 |
62.64 |
5.78 |
-8.62 |
-1.06 |
0 |
|
|
126530 |
50967269 |
1 |
N5H9C11 |
A5B9C11 |
105.62 |
4.97 |
-8.66 |
-1.12 |
0 |
|
|
126531 |
50967270 |
1 |
N3O4C16H19 |
A3B4C16D19 |
-145.17 |
5.62 |
-9.05 |
-0.35 |
0 |
|
|
126532 |
50967271 |
1 |
OSN3H19C21 |
ABC3D19E21 |
64.52 |
6.06 |
-8.6 |
-0.73 |
0 |
|
|
126533 |
50967272 |
1 |
ON5C19H25 |
AB5C19D25 |
-7.67 |
3.95 |
-9.05 |
-0.3 |
0 |
|
|
126534 |
50967361 |
1 |
O2N3C22H25 |
A2B3C22D25 |
-7.56 |
3.11 |
-8.73 |
-0.7 |
0 |
|
|
126535 |
50967362 |
1 |
O2N6C19H28 |
A2B6C19D28 |
-52.8 |
3.13 |
-9.33 |
-0.56 |
0 |