List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
205345 |
80090838 |
1 |
BrClNSC16H19 |
ABCDE16F19 |
25.35 |
3.56 |
-9.11 |
-0.88 |
0 |
|
|
205346 |
80091056 |
1 |
BrClN2O3C13H16 |
ABC2D3E13F16 |
-127.43 |
4.82 |
-9.27 |
-0.76 |
0 |
|
|
205347 |
80091057 |
1 |
BrClN2O3C13H16 |
ABC2D3E13F16 |
-133.87 |
4.13 |
-9.0 |
-0.51 |
0 |
|
|
205348 |
80091155 |
1 |
ClOSN2C14H15 |
ABCD2E14F15 |
12.1 |
5.11 |
-8.88 |
-0.58 |
0 |
|
|
205349 |
80091156 |
1 |
ClN2O2C12H13 |
AB2C2D12E13 |
-44.31 |
4.49 |
-8.99 |
-0.66 |
0 |
|
|
205350 |
80091157 |
1 |
ClN2O2C11H11 |
AB2C2D11E11 |
-35.64 |
4.23 |
-9.05 |
-0.71 |
0 |
|
|
205351 |
80091400 |
1 |
O2N3C14H19 |
A2B3C14D19 |
-60.93 |
5.04 |
-9.55 |
-0.16 |
0 |
|
|
205352 |
80091476 |
1 |
N3C16H27 |
A3B16C27 |
-3.84 |
1.98 |
-8.36 |
0.21 |
0 |
|
|
205353 |
80091484 |
1 |
BrClN2O2H12C14 |
ABC2D2E12F14 |
-35.46 |
6.56 |
-8.59 |
-0.62 |
0 |
|
|
205354 |
80091660 |
1 |
SO2N3C13H27 |
AB2C3D13E27 |
-113.29 |
3.0 |
-8.95 |
0.09 |
0 |
|
|
205355 |
80091661 |
1 |
SF2N2O2C13H18 |
AB2C2D2E13F18 |
-163.02 |
5.29 |
-9.19 |
-1.03 |
0 |
|
|
205356 |
80091662 |
1 |
ON3C16H25 |
AB3C16D25 |
-52.1 |
4.1 |
-8.74 |
-0.09 |
0 |
|
|
205357 |
80091683 |
1 |
BrON3C13H14 |
ABC3D13E14 |
2.42 |
0.64 |
-9.11 |
-0.34 |
0 |
|
|
205358 |
80091685 |
1 |
O2N3C13H13 |
A2B3C13D13 |
-28.9 |
5.11 |
-9.25 |
-1.0 |
0 |
|
|
205359 |
80091686 |
2 |
NOC7H7 |
ABC7D7 |
-46.06 |
4.93 |
-8.67 |
-0.73 |
0 |
|
|
205360 |
80091687 |
1 |
N2O3C12H12 |
A2B3C12D12 |
-69.33 |
6.32 |
-8.89 |
-0.86 |
0 |
|
|
205361 |
80092139 |
1 |
N3O4H11C12 |
A3B4C11D12 |
-140.56 |
5.99 |
-10.26 |
-1.48 |
0 |
|
|
205362 |
80092140 |
1 |
BrClFON2H9C13 |
ABCDE2F9G13 |
-42.99 |
7.05 |
-9.04 |
-0.86 |
0 |
|
|
205363 |
80092141 |
1 |
BrClFON2H9C13 |
ABCDE2F9G13 |
-42.4 |
8.39 |
-8.99 |
-0.8 |
0 |
|
|
205364 |
80092142 |
1 |
BrClON4C13H14 |
ABCD4E13F14 |
7.89 |
4.75 |
-8.97 |
-0.74 |
0 |
|
|
205365 |
80092143 |
1 |
BrClON2H12C14 |
ABCD2E12F14 |
-6.39 |
7.42 |
-8.78 |
-0.63 |
0 |
|
|
205366 |
80092331 |
1 |
N3C15H25 |
A3B15C25 |
1.25 |
3.22 |
-8.94 |
0.17 |
0 |
|
|
205367 |
80092466 |
1 |
SO2N4C10H18 |
AB2C4D10E18 |
-61.31 |
8.54 |
-9.7 |
0.06 |
0 |
|
|
205368 |
80092467 |
1 |
ON3C11H17 |
AB3C11D17 |
-32.93 |
3.67 |
-9.08 |
-0.1 |
0 |
|
|
205369 |
80092468 |
1 |
ON3C15H23 |
AB3C15D23 |
-43.25 |
4.27 |
-8.66 |
-0.02 |
0 |
|
|
205370 |
80092469 |
1 |
ON3C13H19 |
AB3C13D19 |
-36.35 |
3.92 |
-8.62 |
0.01 |
0 |
|
|
205371 |
80092470 |
1 |
ON3C13H21 |
AB3C13D21 |
-50.48 |
3.78 |
-9.07 |
-0.07 |
0 |
|
|
205372 |
80092571 |
1 |
FSN3H12C14 |
ABC3D12E14 |
19.73 |
4.05 |
-8.89 |
-0.81 |
0 |
|
|
205373 |
80092712 |
1 |
BrClSO2N3C12H13 |
ABCD2E3F12G13 |
-40.39 |
4.57 |
-9.44 |
-0.82 |
0 |
|
|
205374 |
80092909 |
1 |
ClON3H8C10 |
ABC3D8E10 |
38.8 |
1.91 |
-9.68 |
-1.09 |
0 |
|
|
205375 |
80093016 |
1 |
ClNO2H12C14 |
ABC2D12E14 |
-32.59 |
3.4 |
-9.58 |
-0.72 |
0 |
|
|
205376 |
80093157 |
1 |
BrClON3C14H17 |
ABCD3E14F17 |
-9.46 |
2.51 |
-9.39 |
-0.71 |
0 |
|
|
205377 |
80093185 |
1 |
ClO2N3H12C14 |
AB2C3D12E14 |
-24.62 |
1.88 |
-9.13 |
-0.76 |
0 |
|
|
205378 |
80093344 |
1 |
N3O3H11C12 |
A3B3C11D12 |
-35.29 |
1.25 |
-9.88 |
-1.35 |
0 |
|
|
205379 |
80093458 |
1 |
N3O3C14H15 |
A3B3C14D15 |
-40.08 |
6.76 |
-9.62 |
-0.96 |
0 |
|
|
205380 |
80093468 |
1 |
ON2C11H18 |
AB2C11D18 |
-24.36 |
3.26 |
-8.9 |
0.04 |
0 |
|
|
205381 |
80093469 |
1 |
ON2C12H18 |
AB2C12D18 |
2.24 |
2.69 |
-8.9 |
-0.01 |
0 |
|
|
205382 |
80093470 |
1 |
O2N3C14H19 |
A2B3C14D19 |
-4.78 |
2.55 |
-9.22 |
-0.45 |
0 |
|
|
205383 |
80093471 |
1 |
ON2C17H22 |
AB2C17D22 |
-4.81 |
4.08 |
-8.87 |
0.05 |
0 |
|
|
205384 |
80093472 |
1 |
ON2C12H20 |
AB2C12D20 |
-31.34 |
3.01 |
-8.92 |
-0.01 |
0 |
|
|
205385 |
80093774 |
1 |
N3O3C14H15 |
A3B3C14D15 |
-53.7 |
4.43 |
-9.88 |
-1.48 |
0 |
|
|
205386 |
80093831 |
1 |
BrClN2C14H18 |
ABC2D14E18 |
30.31 |
5.93 |
-8.44 |
-0.2 |
0 |
|
|
205387 |
80093832 |
1 |
BrClN2C13H16 |
ABC2D13E16 |
40.22 |
5.64 |
-8.38 |
-0.18 |
0 |
|
|
205388 |
80093833 |
1 |
BrClN2C15H20 |
ABC2D15E20 |
2.63 |
4.1 |
-8.42 |
-0.25 |
0 |
|
|
205389 |
80094177 |
1 |
N2O3C14H16 |
A2B3C14D16 |
-115.94 |
3.52 |
-9.26 |
-0.25 |
0 |
|
|
205390 |
80094209 |
1 |
ON2C18H30 |
AB2C18D30 |
-49.24 |
1.05 |
-8.42 |
0.23 |
0 |
|
|
205391 |
80094367 |
1 |
O2C19H22 |
A2B19C22 |
-58.58 |
1.55 |
-8.9 |
0.04 |
0 |
|
|
205392 |
80094368 |
1 |
O2C19H22 |
A2B19C22 |
-59.59 |
3.36 |
-8.98 |
0.16 |
0 |
|
|
205393 |
80094369 |
1 |
N2O3C12H12 |
A2B3C12D12 |
-95.74 |
4.27 |
-8.98 |
-0.53 |
0 |
|
|
205394 |
80094879 |
1 |
N2O2C17H30 |
A2B2C17D30 |
-115.89 |
1.86 |
-9.61 |
0.75 |
0 |