List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
252400 |
103111107 |
2 |
ON2C7H12 |
AB2C7D12 |
-64.75 |
3.47 |
-9.82 |
-0.45 |
0 |
|
|
252401 |
103111119 |
1 |
N5C13H13 |
A5B13C13 |
95.35 |
9.54 |
-8.87 |
-0.99 |
0 |
|
|
252402 |
103111120 |
1 |
O4N5C12H17 |
A4B5C12D17 |
-49.03 |
3.01 |
-10.18 |
-0.49 |
0 |
|
|
252403 |
103111121 |
2 |
N3C7H8 |
A3B7C8 |
92.05 |
4.13 |
-8.56 |
-0.56 |
0 |
|
|
252404 |
103111135 |
1 |
O3N4C11H20 |
A3B4C11D20 |
-91.21 |
4.61 |
-9.86 |
-0.18 |
0 |
|
|
252405 |
103111145 |
1 |
O3N4C11H20 |
A3B4C11D20 |
-96.74 |
4.74 |
-10.19 |
-0.47 |
0 |
|
|
252406 |
103111149 |
2 |
N2C8H11 |
A2B8C11 |
25.46 |
2.37 |
-8.46 |
0.14 |
0 |
|
|
252407 |
103111152 |
1 |
N5C14H15 |
A5B14C15 |
91.56 |
4.94 |
-8.49 |
-0.46 |
0 |
|
|
252408 |
103111171 |
1 |
O2N4C15H22 |
A2B4C15D22 |
2.65 |
4.97 |
-9.36 |
-1.26 |
0 |
|
|
252409 |
103111174 |
2 |
ON2C4H7 |
AB2C4D7 |
-41.26 |
3.9 |
-10.08 |
-0.44 |
0 |
|
|
252410 |
103111181 |
1 |
N2O4H12C13 |
A2B4C12D13 |
-53.12 |
6.43 |
-10.11 |
-1.63 |
0 |
|
|
252411 |
103111182 |
1 |
O3N4C10H18 |
A3B4C10D18 |
-91.94 |
2.38 |
-10.14 |
-0.49 |
0 |
|
|
252412 |
103111186 |
1 |
F2O2N4C13H14 |
A2B2C4D13E14 |
-101.89 |
4.24 |
-10.11 |
-0.84 |
0 |
|
|
252413 |
103111187 |
1 |
N3O5C13H23 |
A3B5C13D23 |
-253.64 |
4.45 |
-9.54 |
0.24 |
0 |
|
|
252414 |
103111198 |
1 |
O2N5C9H17 |
A2B5C9D17 |
-38.83 |
3.22 |
-9.65 |
-0.36 |
0 |
|
|
252415 |
103111205 |
1 |
N3O3C14H17 |
A3B3C14D17 |
-101.69 |
1.24 |
-9.07 |
-1.0 |
0 |
|
|
252416 |
103111206 |
1 |
O3N5C12H17 |
A3B5C12D17 |
-30.83 |
4.6 |
-10.22 |
-0.55 |
0 |
|
|
252417 |
103111211 |
1 |
O3N4C9H16 |
A3B4C9D16 |
-90.35 |
2.31 |
-10.2 |
-0.48 |
0 |
|
|
252418 |
103111213 |
1 |
O2N6C13H20 |
A2B6C13D20 |
-3.73 |
6.03 |
-9.54 |
-0.28 |
0 |
|
|
252419 |
103111217 |
1 |
SN4O4C12H18 |
AB4C4D12E18 |
-61.27 |
2.87 |
-9.29 |
-1.41 |
0 |
|
|
252420 |
103111227 |
1 |
O2N4C13H20 |
A2B4C13D20 |
-78.02 |
3.03 |
-8.08 |
0.24 |
0 |
|
|
252421 |
103111236 |
2 |
ON2C7H11 |
AB2C7D11 |
-76.15 |
2.44 |
-9.01 |
-0.46 |
0 |
|
|
252422 |
103111238 |
1 |
SO3N6C11H14 |
AB3C6D11E14 |
-34.65 |
4.63 |
-9.21 |
-0.88 |
0 |
|
|
252423 |
103111247 |
2 |
ON2C7H12 |
AB2C7D12 |
-80.59 |
4.66 |
-8.32 |
-0.31 |
0 |
|
|
252424 |
103111272 |
1 |
ON3C15H19 |
AB3C15D19 |
-7.8 |
2.38 |
-8.59 |
-0.6 |
0 |
|
|
252425 |
103111282 |
1 |
O2N5C12H15 |
A2B5C12D15 |
1.82 |
5.81 |
-10.25 |
-0.65 |
0 |
|
|
252426 |
103111288 |
2 |
ON2C5H9 |
AB2C5D9 |
-54.14 |
3.97 |
-10.1 |
-0.35 |
0 |
|
|
252427 |
103111289 |
1 |
O3N5C12H19 |
A3B5C12D19 |
-62.16 |
1.72 |
-9.97 |
-0.64 |
0 |
|
|
252428 |
103111315 |
1 |
SO2N5C10H13 |
AB2C5D10E13 |
6.85 |
2.73 |
-9.85 |
-1.02 |
0 |
|
|
252429 |
103111325 |
1 |
SO2N4C10H18 |
AB2C4D10E18 |
-42.65 |
4.26 |
-8.89 |
-0.55 |
0 |
|
|
252430 |
103111340 |
1 |
O3N4C11H16 |
A3B4C11D16 |
-21.75 |
9.02 |
-9.32 |
-1.35 |
0 |
|
|
252431 |
103111346 |
1 |
ON4C13H18 |
AB4C13D18 |
3.35 |
5.86 |
-8.59 |
-0.4 |
0 |
|
|
252432 |
103111351 |
1 |
FN3O3C12H16 |
AB3C3D12E16 |
-83.95 |
8.45 |
-9.29 |
-1.29 |
0 |
|
|
252433 |
103111358 |
1 |
SN3O3C14H23 |
AB3C3D14E23 |
-112.0 |
10.71 |
-8.91 |
-0.21 |
0 |
|
|
252434 |
103111365 |
1 |
ON5C12H21 |
AB5C12D21 |
-18.04 |
3.4 |
-8.74 |
0.08 |
0 |
|
|
252435 |
103111366 |
1 |
FON3C11H16 |
ABC3D11E16 |
-69.37 |
1.72 |
-8.93 |
-0.43 |
0 |
|
|
252436 |
103111404 |
1 |
BrN2O2H13C16 |
AB2C2D13E16 |
-26.43 |
3.43 |
-8.39 |
-1.69 |
0 |
|
|
252437 |
103111405 |
1 |
O4N5C12H15 |
A4B5C12D15 |
18.52 |
13.29 |
-9.3 |
-1.88 |
0 |
|
|
252438 |
103111416 |
1 |
IO2N4C13H15 |
AB2C4D13E15 |
7.92 |
3.7 |
-9.52 |
-0.99 |
0 |
|
|
252439 |
103111419 |
1 |
N2O2C17H22 |
A2B2C17D22 |
-95.37 |
4.07 |
-8.3 |
0.04 |
0 |
|
|
252440 |
103111420 |
1 |
N4O4C11H20 |
A4B4C11D20 |
-117.02 |
3.92 |
-10.02 |
-0.53 |
0 |
|
|
252441 |
103111422 |
1 |
SN4O4C11H20 |
AB4C4D11E20 |
-130.54 |
5.95 |
-10.41 |
-0.64 |
0 |
|
|
252442 |
103111432 |
1 |
O3N4C12H18 |
A3B4C12D18 |
-44.39 |
7.24 |
-9.32 |
-1.18 |
0 |
|
|
252443 |
103111445 |
1 |
BrON5C12H16 |
ABC5D12E16 |
27.0 |
5.94 |
-9.02 |
-1.1 |
0 |
|
|
252444 |
103111446 |
1 |
SO2N4C10H18 |
AB2C4D10E18 |
-42.32 |
3.6 |
-8.89 |
-0.31 |
0 |
|
|
252445 |
103111451 |
1 |
ClN3O3C12H16 |
AB3C3D12E16 |
-51.7 |
8.3 |
-9.21 |
-1.18 |
0 |
|
|
252446 |
103111453 |
1 |
ClON4C10H15 |
ABC4D10E15 |
-14.1 |
4.43 |
-9.04 |
-0.55 |
0 |
|
|
252447 |
103111455 |
1 |
OCl2N4C10H14 |
AB2C4D10E14 |
-13.46 |
6.96 |
-9.48 |
-1.11 |
0 |
|
|
252448 |
103111460 |
1 |
OSN2H14C15 |
ABC2D14E15 |
12.85 |
3.51 |
-8.37 |
-0.88 |
0 |
|
|
252449 |
103111466 |
1 |
N2O2C11H18 |
A2B2C11D18 |
-87.95 |
3.92 |
-9.24 |
0.04 |
0 |