List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
31273 |
855514 |
1 |
O2N3C19H27 |
A2B3C19D27 |
-81.3 |
3.13 |
-9.04 |
-0.22 |
0 |
|
|
31274 |
855515 |
2 |
NSO2C7H11 |
ABC2D7E11 |
-130.99 |
0.98 |
-10.05 |
-1.27 |
0 |
|
|
31275 |
855516 |
1 |
NSO2H11C12 |
ABC2D11E12 |
-27.49 |
1.16 |
-8.63 |
-0.3 |
0 |
|
|
31276 |
855517 |
1 |
O2N5C17H17 |
A2B5C17D17 |
51.59 |
5.52 |
-8.92 |
-0.58 |
0 |
|
|
31277 |
855518 |
4 |
NH4C5 |
AB4C5 |
149.26 |
5.87 |
-8.17 |
-1.35 |
0 |
|
|
31278 |
855519 |
1 |
ClOSN5H10C13 |
ABCD5E10F13 |
43.99 |
5.78 |
-8.93 |
-1.52 |
0 |
|
|
31279 |
855520 |
1 |
ClSO2N3C14H14 |
ABC2D3E14F14 |
-58.01 |
8.81 |
-8.62 |
-1.05 |
0 |
|
|
31280 |
855521 |
1 |
SO2N4C14H16 |
AB2C4D14E16 |
-12.72 |
8.43 |
-8.99 |
-0.65 |
0 |
|
|
31281 |
855523 |
2 |
ON3C7H9 |
AB3C7D9 |
83.97 |
8.35 |
-9.31 |
-1.7 |
0 |
|
|
31282 |
855524 |
1 |
NO3H9C11 |
AB3C9D11 |
-104.94 |
9.31 |
-9.53 |
-1.68 |
0 |
|
|
31283 |
855525 |
2 |
NOH7C9 |
ABC7D9 |
24.96 |
4.98 |
-8.79 |
-1.23 |
0 |
|
|
31284 |
855526 |
1 |
OSN2H14C19 |
ABC2D14E19 |
64.34 |
5.85 |
-8.87 |
-1.16 |
0 |
|
|
31285 |
855527 |
1 |
OSN3H17C20 |
ABC3D17E20 |
43.28 |
8.68 |
-8.54 |
-1.57 |
0 |
|
|
31286 |
855529 |
2 |
NOH7C9 |
ABC7D9 |
26.08 |
4.98 |
-8.8 |
-1.3 |
0 |
|
|
31287 |
855530 |
1 |
N2O3H14C18 |
A2B3C14D18 |
-3.19 |
6.3 |
-8.74 |
-1.41 |
0 |
|
|
31288 |
855532 |
1 |
OSN3C18H21 |
ABC3D18E21 |
26.85 |
5.56 |
-8.74 |
-1.2 |
0 |
|
|
31289 |
855533 |
1 |
SO2N3C17H19 |
AB2C3D17E19 |
-0.42 |
5.55 |
-8.82 |
-1.36 |
0 |
|
|
31290 |
855534 |
1 |
ClN2H17C18 |
AB2C17D18 |
58.73 |
3.27 |
-9.16 |
-0.79 |
0 |
|
|
31291 |
855535 |
1 |
ClN2C19H19 |
AB2C19D19 |
49.15 |
2.32 |
-8.94 |
-0.69 |
0 |
|
|
31292 |
855536 |
1 |
SN2O6C14H16 |
AB2C6D14E16 |
-181.48 |
3.22 |
-7.89 |
-0.57 |
0 |
|
|
31293 |
855537 |
1 |
SO2N3C13H13 |
AB2C3D13E13 |
-7.51 |
7.14 |
-8.7 |
-0.55 |
0 |
|
|
31294 |
855538 |
1 |
SO2N3C14H15 |
AB2C3D14E15 |
-18.22 |
2.56 |
-8.61 |
-0.93 |
0 |
|
|
31295 |
855539 |
1 |
SO2N3C18H23 |
AB2C3D18E23 |
-13.06 |
6.07 |
-8.26 |
-0.32 |
0 |
|
|
31296 |
855540 |
1 |
NO3C18H21 |
AB3C18D21 |
-82.28 |
3.92 |
-8.43 |
0.05 |
0 |
|
|
31297 |
855541 |
1 |
SN2O2C18H22 |
AB2C2D18E22 |
-19.81 |
5.46 |
-8.27 |
-0.16 |
0 |
|
|
31298 |
855542 |
1 |
SO3N4C15H18 |
AB3C4D15E18 |
13.73 |
9.13 |
-9.01 |
-1.49 |
0 |
|
|
31299 |
855543 |
1 |
SO3N4C15H18 |
AB3C4D15E18 |
14.11 |
8.21 |
-9.12 |
-1.62 |
0 |
|
|
31300 |
855544 |
2 |
OSN2C7H7 |
ABC2D7E7 |
1.64 |
0.94 |
-8.82 |
-1.41 |
0 |
|
|
31301 |
855545 |
1 |
ClSN2O2H13C17 |
ABC2D2E13F17 |
-10.32 |
2.72 |
-9.1 |
-1.44 |
0 |
|
|
31302 |
855546 |
1 |
O3N4H12C15 |
A3B4C12D15 |
-18.88 |
7.46 |
-9.72 |
-1.11 |
0 |
|
|
31303 |
855548 |
1 |
NSO6C12H15 |
ABC6D12E15 |
-237.11 |
5.15 |
-8.72 |
-0.22 |
0 |
|
|
31304 |
855549 |
1 |
ClSN2O2C12H13 |
ABC2D2E12F13 |
-64.6 |
5.54 |
-9.04 |
-0.92 |
0 |
|
|
31305 |
855551 |
1 |
OSN5C11H17 |
ABC5D11E17 |
-28.77 |
5.03 |
-9.02 |
-0.26 |
0 |
|
|
31306 |
855553 |
1 |
OSN5C13H17 |
ABC5D13E17 |
34.96 |
4.13 |
-8.42 |
-0.94 |
0 |
|
|
31307 |
855555 |
1 |
OSN4C11H18 |
ABC4D11E18 |
-18.0 |
4.91 |
-9.09 |
-0.46 |
0 |
|
|
31308 |
855556 |
1 |
SN3O3C13H15 |
AB3C3D13E15 |
-37.82 |
5.89 |
-8.82 |
-0.9 |
0 |
|
|
31309 |
855557 |
1 |
SO3N4C13H14 |
AB3C4D13E14 |
-51.97 |
8.4 |
-9.21 |
-1.02 |
0 |
|
|
31310 |
855559 |
1 |
SN3O3H15C16 |
AB3C3D15E16 |
-15.25 |
4.87 |
-8.54 |
-1.19 |
0 |
|
|
31311 |
855561 |
1 |
N2S2O3C13H14 |
A2B2C3D13E14 |
-77.86 |
7.66 |
-8.86 |
-1.24 |
0 |
|
|
31312 |
855562 |
1 |
NSO2H19C20 |
ABC2D19E20 |
-26.68 |
2.34 |
-8.74 |
-0.85 |
0 |
|
|
31313 |
855563 |
1 |
NSO2H17C19 |
ABC2D17E19 |
-18.66 |
2.15 |
-8.73 |
-0.86 |
0 |
|
|
31314 |
855564 |
1 |
N3O3H13C14 |
A3B3C13D14 |
-44.11 |
4.49 |
-8.99 |
-1.04 |
0 |
|
|
31315 |
855565 |
1 |
SN2O3C18H22 |
AB2C3D18E22 |
-87.9 |
6.48 |
-8.76 |
-0.94 |
0 |
|
|
31316 |
855566 |
1 |
NSO4H13C14 |
ABC4D13E14 |
-115.17 |
7.15 |
-8.93 |
-1.22 |
0 |
|
|
31317 |
855567 |
1 |
NSO4C17H19 |
ABC4D17E19 |
-132.13 |
3.05 |
-8.6 |
-0.97 |
0 |
|
|
31318 |
855568 |
1 |
SN2O2C14H16 |
AB2C2D14E16 |
-53.83 |
5.18 |
-8.78 |
-1.0 |
0 |
|
|
31319 |
855569 |
1 |
SO2N4C17H22 |
AB2C4D17E22 |
-39.24 |
8.5 |
-9.0 |
-0.74 |
0 |
|
|
31320 |
855570 |
1 |
SO2N4C16H22 |
AB2C4D16E22 |
-35.52 |
4.66 |
-8.51 |
-0.64 |
0 |
|
|
31321 |
855572 |
1 |
FSO2N5C13H14 |
ABC2D5E13F14 |
-19.43 |
5.27 |
-9.37 |
-1.21 |
0 |
|
|
31322 |
855573 |
1 |
FSO2N4C15H17 |
ABC2D4E15F17 |
-43.9 |
3.86 |
-9.5 |
-1.23 |
0 |