List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
127322 |
50998350 |
1 |
ClFSN2O2H10C12 |
ABCD2E2F10G12 |
-90.02 |
9.41 |
-8.81 |
-0.63 |
0 |
|
|
127323 |
50998351 |
1 |
ClFSN2O2H10C12 |
ABCD2E2F10G12 |
-91.24 |
8.15 |
-8.8 |
-0.62 |
0 |
|
|
127324 |
50998420 |
1 |
ClSF2O3H5C7 |
ABC2D3E5F7 |
-191.19 |
6.98 |
-10.16 |
-1.51 |
0 |
|
|
127325 |
50998421 |
1 |
OSF2H6C7 |
ABC2D6E7 |
-105.97 |
1.6 |
-8.63 |
-0.56 |
0 |
|
|
127327 |
50998599 |
1 |
ClNC10H10 |
ABC10D10 |
27.84 |
5.53 |
-9.72 |
-0.87 |
0 |
|
|
127328 |
50998675 |
1 |
BN2O9C27H33 |
AB2C9D27E33 |
-401.62 |
3.13 |
-8.77 |
-0.27 |
0 |
|
|
127329 |
50998736 |
1 |
ClSF2O2H3C6 |
ABC2D2E3F6 |
-148.32 |
2.23 |
-9.51 |
-1.34 |
0 |
|
|
127330 |
50998737 |
1 |
ClNaSO2C8H8 |
ABCD2E8F8 |
-108.47 |
5.67 |
-7.54 |
0.4 |
0 |
|
|
127331 |
50998747 |
1 |
ClNaSO2H6C7 |
ABCD2E6F7 |
-101.16 |
4.44 |
-7.76 |
-0.02 |
0 |
|
|
127332 |
50998748 |
1 |
ClNaSF3H3O3C7 |
ABCD3E3F3G7 |
-309.33 |
7.8 |
-10.23 |
-1.14 |
0 |
|
|
127333 |
50998758 |
1 |
NaSF2O2H3C6 |
ABC2D2E3F6 |
-184.88 |
4.8 |
-7.75 |
-0.05 |
0 |
|
|
127334 |
50998781 |
1 |
ClNH6C8 |
ABC6D8 |
66.05 |
3.64 |
-8.64 |
-0.26 |
0 |
|
|
127335 |
50998893 |
2 |
ON2C4H9 |
AB2C4D9 |
-79.3 |
5.38 |
-9.41 |
0.82 |
0 |
|
|
127336 |
50998907 |
1 |
ClN2O2F3C14H16 |
AB2C2D3E14F16 |
-238.94 |
5.61 |
-9.07 |
-0.92 |
0 |
|
|
127337 |
50998908 |
1 |
NSO3C9H11 |
ABC3D9E11 |
-101.33 |
4.25 |
-9.97 |
-1.31 |
0 |
|
|
127338 |
50998909 |
1 |
O2N3C12H17 |
A2B3C12D17 |
-12.15 |
2.79 |
-8.81 |
0.06 |
0 |
|
|
127339 |
50998910 |
1 |
O2F3N4C15H21 |
A2B3C4D15E21 |
-210.46 |
4.3 |
-9.53 |
-0.04 |
0 |
|
|
127340 |
50998975 |
1 |
ClNO3C11H14 |
ABC3D11E14 |
-123.84 |
3.35 |
-9.03 |
-0.26 |
0 |
|
|
127341 |
50998976 |
1 |
NOC8H19 |
ABC8D19 |
-85.94 |
3.85 |
-9.59 |
3.12 |
0 |
|
|
127342 |
50998977 |
1 |
NOC8H19 |
ABC8D19 |
-85.23 |
1.44 |
-9.39 |
2.73 |
0 |
|
|
127343 |
50998991 |
1 |
ClNO2C10H14 |
ABC2D10E14 |
-109.06 |
5.4 |
-9.97 |
-0.31 |
0 |
|
|
127344 |
50998992 |
1 |
ClNO2C10H14 |
ABC2D10E14 |
-109.32 |
4.39 |
-9.75 |
-0.03 |
0 |
|
|
127345 |
50999087 |
1 |
O3N4C15H22 |
A3B4C15D22 |
-121.94 |
4.09 |
-8.83 |
-0.52 |
0 |
|
|
127346 |
50999093 |
2 |
NO3C11H15 |
AB3C11D15 |
-254.15 |
3.99 |
-9.24 |
-0.68 |
0 |
|
|
127347 |
50999244 |
1 |
NO5C15H19 |
AB5C15D19 |
-203.73 |
6.52 |
-9.9 |
-0.44 |
0 |
|
|
127348 |
50999341 |
2 |
NOC12H12 |
ABC12D12 |
26.55 |
2.24 |
-9.21 |
-0.55 |
0 |
|
|
127349 |
50999367 |
1 |
N2O3C12H18 |
A2B3C12D18 |
-112.53 |
2.71 |
-8.69 |
0.0 |
0 |
|
|
127350 |
50999403 |
1 |
NF3O3H8C13 |
AB3C3D8E13 |
-225.53 |
4.66 |
-10.03 |
-1.35 |
0 |
|
|
127351 |
50999458 |
1 |
ClON2C4H11 |
ABC2D4E11 |
-71.74 |
1.92 |
-9.91 |
0.62 |
0 |
|
|
127352 |
50999459 |
1 |
ClN2O2C5H7 |
AB2C2D5E7 |
-41.32 |
1.84 |
-9.24 |
-0.61 |
0 |
|
|
127353 |
50999529 |
1 |
O2N3C7H11 |
A2B3C7D11 |
-49.04 |
2.26 |
-8.53 |
0.1 |
0 |
|
|
127354 |
50999617 |
1 |
ON3C11H11 |
AB3C11D11 |
39.76 |
2.71 |
-8.46 |
-0.92 |
0 |
|
|
127355 |
50999625 |
1 |
O2N3C14H17 |
A2B3C14D17 |
36.65 |
7.64 |
-9.82 |
-0.87 |
0 |
|
|
127356 |
50999626 |
1 |
O2F3N3H8C11 |
A2B3C3D8E11 |
-93.21 |
7.15 |
-10.74 |
-1.3 |
0 |
|
|
127357 |
50999627 |
1 |
O2N3C12H13 |
A2B3C12D13 |
47.46 |
8.56 |
-9.68 |
-0.85 |
0 |
|
|
127358 |
50999628 |
1 |
ClN2F3C12H14 |
AB2C3D12E14 |
-143.09 |
4.28 |
-9.08 |
-0.79 |
0 |
|
|
127359 |
50999629 |
3 |
NF2H3C4 |
AB2C3D4 |
-253.78 |
2.57 |
-8.64 |
-1.35 |
0 |
|
|
127360 |
50999688 |
1 |
NO3H17C18 |
AB3C17D18 |
-65.85 |
5.47 |
-8.55 |
-0.66 |
0 |
|
|
127361 |
50999962 |
1 |
N4O5H10C11 |
A4B5C10D11 |
28.56 |
3.2 |
-10.07 |
-1.72 |
0 |
|
|
127362 |
51000042 |
1 |
N3C10H19 |
A3B10C19 |
4.44 |
3.29 |
-8.26 |
1.08 |
0 |
|
|
127363 |
51000246 |
1 |
O2N3C17H27 |
A2B3C17D27 |
-108.92 |
2.64 |
-8.03 |
0.45 |
0 |
|
|
127364 |
51000331 |
1 |
O2N3C7H11 |
A2B3C7D11 |
16.81 |
7.24 |
-10.59 |
-0.94 |
0 |
|
|
127365 |
51000354 |
2 |
NOC6H11 |
ABC6D11 |
-118.26 |
3.67 |
-8.96 |
1.32 |
0 |
|
|
127366 |
51000355 |
1 |
ON2C15H22 |
AB2C15D22 |
-36.56 |
3.31 |
-9.04 |
0.13 |
0 |
|
|
127367 |
51000356 |
1 |
ClNC8H18 |
ABC8D18 |
-47.67 |
3.13 |
-9.3 |
1.91 |
0 |
|
|
127368 |
51000376 |
1 |
ClNSO4H6C8 |
ABCD4E6F8 |
-137.51 |
7.04 |
-10.15 |
-1.64 |
0 |
|
|
127369 |
51000420 |
1 |
ON6C19H26 |
AB6C19D26 |
24.49 |
3.27 |
-8.28 |
-0.49 |
0 |
|
|
127370 |
51000627 |
1 |
S2O6N7C31H39 |
A2B6C7D31E39 |
-171.86 |
9.1 |
-8.72 |
-0.97 |
0 |
|
|
127371 |
51000652 |
1 |
ClN6C22H25 |
AB6C22D25 |
100.55 |
3.7 |
-8.57 |
-0.45 |
0 |
|
|
127372 |
51000653 |
1 |
FN4C24H27 |
AB4C24D27 |
43.05 |
2.98 |
-7.95 |
-0.24 |
0 |
|
|
127373 |
51000661 |
1 |
NO2S2H17C19 |
AB2C2D17E19 |
11.57 |
2.81 |
-8.82 |
-1.41 |
0 |
|
|
127374 |
51000679 |
1 |
N4O4C23H28 |
A4B4C23D28 |
-77.47 |
2.85 |
-8.47 |
-0.72 |
0 |
|
|
127375 |
51000763 |
1 |
SN4O5C32H36 |
AB4C5D32E36 |
-119.36 |
9.51 |
-9.37 |
-0.83 |
0 |
|
|
127376 |
51000766 |
1 |
N3S7C33O47H55 |
A3B7C33D47E55 |
-1970.06 |
10.8 |
-10.44 |
-1.49 |
0 |
|
|
127377 |
51000767 |
1 |
N6O11C43H68 |
A6B11C43D68 |
-547.8 |
7.19 |
-8.77 |
0.1 |
0 |
|
|
127378 |
51000768 |
1 |
ON5C20H23 |
AB5C20D23 |
20.33 |
3.21 |
-8.47 |
-0.22 |
0 |
|
|
127379 |
51000769 |
1 |
O2N5C19H21 |
A2B5C19D21 |
-1.43 |
4.04 |
-8.32 |
-0.06 |
0 |
|
|
127380 |
51000770 |
1 |
ON6C20H24 |
AB6C20D24 |
30.91 |
6.0 |
-8.58 |
-0.3 |
0 |
|
|
127381 |
51000771 |
1 |
ON6C20H24 |
AB6C20D24 |
24.88 |
6.64 |
-8.27 |
0.01 |
0 |
|
|
127382 |
51000772 |
1 |
ON6C20H24 |
AB6C20D24 |
25.75 |
3.92 |
-8.43 |
-0.35 |
0 |
|
|
127383 |
51000773 |
1 |
ON6C20H24 |
AB6C20D24 |
37.7 |
2.07 |
-8.56 |
-0.3 |
0 |
|
|
127384 |
51000774 |
1 |
ON6C23H30 |
AB6C23D30 |
10.95 |
3.35 |
-8.42 |
-0.21 |
0 |
|
|
127385 |
51000775 |
1 |
ON6H22C23 |
AB6C22D23 |
70.2 |
5.65 |
-8.21 |
-1.03 |
0 |
|
|
127386 |
51000776 |
1 |
ON6C22H22 |
AB6C22D22 |
56.28 |
3.54 |
-8.41 |
-0.36 |
0 |
|
|
127387 |
51000777 |
1 |
O2N5H23C24 |
A2B5C23D24 |
12.3 |
3.06 |
-8.41 |
-0.58 |
0 |
|
|
127388 |
51000778 |
1 |
ON6C24H24 |
AB6C24D24 |
57.22 |
7.06 |
-8.3 |
-0.23 |
0 |
|
|
127389 |
51000779 |
1 |
ON6C25H26 |
AB6C25D26 |
56.62 |
3.15 |
-8.44 |
-0.15 |
0 |
|
|
127390 |
51000780 |
1 |
O2N5C25H25 |
A2B5C25D25 |
12.4 |
2.99 |
-8.21 |
-0.16 |
0 |
|
|
127391 |
51000781 |
1 |
N3O4C26H27 |
A3B4C26D27 |
-111.44 |
2.61 |
-8.93 |
-1.22 |
0 |
|
|
127392 |
51000782 |
1 |
N3O4C28H29 |
A3B4C28D29 |
-96.77 |
2.89 |
-8.22 |
-1.16 |
0 |
|
|
127393 |
51000783 |
1 |
SO3N4H22C26 |
AB3C4D22E26 |
-6.01 |
2.91 |
-8.94 |
-1.26 |
0 |
|
|
127394 |
51000784 |
1 |
ClN3O4H20C23 |
AB3C4D20E23 |
-61.05 |
5.01 |
-9.11 |
-1.37 |
0 |
|
|
127395 |
51000785 |
1 |
N3O3C25H25 |
A3B3C25D25 |
-58.05 |
4.26 |
-8.88 |
-1.19 |
0 |
|
|
127396 |
51000786 |
1 |
SN3O3C28H31 |
AB3C3D28E31 |
-60.69 |
4.06 |
-8.43 |
-1.19 |
0 |
|
|
127397 |
51000787 |
1 |
FSO2N4H25C29 |
ABC2D4E25F29 |
-29.94 |
1.31 |
-8.86 |
-1.29 |
0 |