List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
126336 |
50960220 |
1 |
ON6C15H20 |
AB6C15D20 |
26.44 |
5.8 |
-8.85 |
-0.46 |
0 |
|
|
126337 |
50960221 |
1 |
ON6C18H30 |
AB6C18D30 |
-5.78 |
3.71 |
-8.58 |
0.24 |
0 |
|
|
126338 |
50960222 |
1 |
FOSN2C18H25 |
ABCD2E18F25 |
-80.78 |
3.38 |
-8.78 |
-0.2 |
0 |
|
|
126339 |
50960223 |
1 |
ClN3O3H14C18 |
AB3C3D14E18 |
-41.62 |
7.21 |
-8.51 |
-1.08 |
0 |
|
|
126340 |
50960224 |
1 |
FN6H13C18 |
AB6C13D18 |
106.02 |
1.8 |
-9.52 |
-1.67 |
0 |
|
|
126341 |
50960225 |
1 |
SN3O3C13H21 |
AB3C3D13E21 |
-128.66 |
5.72 |
-9.44 |
0.06 |
0 |
|
|
126342 |
50960585 |
5 |
NC3H3 |
AB3C3 |
114.86 |
2.3 |
-8.95 |
-0.02 |
0 |
|
|
126343 |
50960666 |
1 |
ClON5C11H14 |
ABC5D11E14 |
19.93 |
9.96 |
-8.84 |
-0.6 |
0 |
|
|
126344 |
50960717 |
1 |
SO2N5C17H23 |
AB2C5D17E23 |
-35.5 |
3.54 |
-9.16 |
-0.84 |
0 |
|
|
126345 |
50960873 |
2 |
ON2H8C10 |
AB2C8D10 |
54.85 |
1.53 |
-9.41 |
-1.22 |
0 |
|
|
126346 |
50961107 |
1 |
ON5C19H19 |
AB5C19D19 |
65.78 |
5.62 |
-9.3 |
-1.1 |
0 |
|
|
126347 |
50961303 |
1 |
ON5C21H27 |
AB5C21D27 |
33.12 |
5.64 |
-8.5 |
-0.09 |
0 |
|
|
126348 |
50961318 |
1 |
SO2N5C19H23 |
AB2C5D19E23 |
8.65 |
6.86 |
-8.86 |
-0.52 |
0 |
|
|
126349 |
50961364 |
1 |
S2N3O4C14H17 |
A2B3C4D14E17 |
-108.47 |
3.75 |
-9.71 |
-1.04 |
0 |
|
|
126350 |
50961406 |
1 |
N3O3C20H25 |
A3B3C20D25 |
-87.69 |
6.67 |
-8.65 |
0.07 |
0 |
|
|
126351 |
50961407 |
1 |
N3O4C20H21 |
A3B4C20D21 |
-84.37 |
8.05 |
-8.79 |
-0.31 |
0 |
|
|
126352 |
50961455 |
1 |
ON3C15H23 |
AB3C15D23 |
-16.6 |
3.43 |
-9.3 |
0.19 |
0 |
|
|
126353 |
50961470 |
2 |
ON2C8H14 |
AB2C8D14 |
-89.28 |
5.73 |
-9.06 |
0.76 |
0 |
|
|
126354 |
50961551 |
1 |
O3N4C18H18 |
A3B4C18D18 |
13.17 |
7.63 |
-9.26 |
-0.91 |
0 |
|
|
126355 |
50961552 |
1 |
ClON4C11H13 |
ABC4D11E13 |
1.06 |
3.33 |
-9.33 |
-0.57 |
0 |
|
|
126356 |
50961766 |
2 |
N3H8C9 |
A3B8C9 |
148.34 |
2.31 |
-8.95 |
-0.99 |
0 |
|
|
126357 |
50962072 |
1 |
OSN4H14C15 |
ABC4D14E15 |
37.46 |
0.81 |
-8.89 |
-1.21 |
0 |
|
|
126358 |
50962073 |
1 |
SO4N5C16H19 |
AB4C5D16E19 |
-80.17 |
6.5 |
-8.82 |
-0.24 |
0 |
|
|
126359 |
50962074 |
1 |
O4N5C18H23 |
A4B5C18D23 |
-93.52 |
3.94 |
-9.35 |
-1.24 |
0 |
|
|
126360 |
50962075 |
1 |
FN2O2C19H21 |
AB2C2D19E21 |
-96.81 |
4.21 |
-8.69 |
-0.2 |
0 |
|
|
126361 |
50962268 |
1 |
N3O3C19H21 |
A3B3C19D21 |
-100.6 |
2.59 |
-8.72 |
-0.51 |
0 |
|
|
126362 |
50962269 |
1 |
O2N5C15H23 |
A2B5C15D23 |
-59.46 |
8.45 |
-8.97 |
0.47 |
0 |
|
|
126363 |
50962270 |
1 |
ClOSN4H15C16 |
ABCD4E15F16 |
39.25 |
5.89 |
-8.77 |
-0.81 |
0 |
|
|
126364 |
50962271 |
1 |
ON4C17H22 |
AB4C17D22 |
1.9 |
2.24 |
-9.45 |
-0.32 |
0 |
|
|
126365 |
50962272 |
1 |
O2N3C18H29 |
A2B3C18D29 |
-95.53 |
5.47 |
-8.41 |
0.28 |
0 |
|
|
126366 |
50962273 |
1 |
O2N5C15H19 |
A2B5C15D19 |
-38.06 |
5.91 |
-9.12 |
-0.64 |
0 |
|
|
126367 |
50962274 |
1 |
S2N5C8H11 |
A2B5C8D11 |
97.28 |
7.5 |
-9.31 |
-1.19 |
0 |
|
|
126368 |
50962275 |
1 |
NO2C16H21 |
AB2C16D21 |
-59.12 |
5.06 |
-9.31 |
-0.04 |
0 |
|
|
126369 |
50962276 |
1 |
SN3O3C18H19 |
AB3C3D18E19 |
-87.6 |
3.66 |
-9.22 |
-0.72 |
0 |
|
|
126370 |
50962341 |
1 |
NSO3C19H23 |
ABC3D19E23 |
-99.83 |
5.74 |
-9.04 |
-0.24 |
0 |
|
|
126371 |
50962343 |
1 |
N3O4C16H27 |
A3B4C16D27 |
-200.29 |
7.13 |
-9.47 |
0.07 |
0 |
|
|
126372 |
50962349 |
1 |
FO2N5C19H22 |
AB2C5D19E22 |
-49.36 |
1.82 |
-9.26 |
-0.22 |
0 |
|
|
126373 |
50962350 |
1 |
ClN2O3C16H19 |
AB2C3D16E19 |
-133.7 |
7.49 |
-9.12 |
-0.63 |
0 |
|
|
126374 |
50962351 |
1 |
ON5C20H29 |
AB5C20D29 |
7.45 |
8.91 |
-8.8 |
-0.4 |
0 |
|
|
126375 |
50962420 |
1 |
O2N7C18H23 |
A2B7C18D23 |
-28.34 |
3.72 |
-8.94 |
-0.64 |
0 |
|
|
126376 |
50962423 |
1 |
O2N3C21H29 |
A2B3C21D29 |
-80.5 |
6.11 |
-8.27 |
-0.33 |
0 |
|
|
126377 |
50962444 |
1 |
FN4O4C19H19 |
AB4C4D19E19 |
-139.03 |
2.54 |
-9.49 |
-0.76 |
0 |
|
|
126378 |
50962445 |
1 |
N2O3C13H16 |
A2B3C13D16 |
-68.19 |
2.35 |
-8.56 |
-0.26 |
0 |
|
|
126379 |
50962514 |
1 |
N3O4C16H21 |
A3B4C16D21 |
-82.17 |
2.07 |
-9.37 |
-0.82 |
0 |
|
|
126380 |
50962515 |
1 |
N3O4C17H19 |
A3B4C17D19 |
-115.15 |
5.34 |
-8.99 |
-0.58 |
0 |
|
|
126381 |
50962516 |
1 |
ClON5C18H20 |
ABC5D18E20 |
28.81 |
5.78 |
-8.61 |
-0.61 |
0 |
|
|
126382 |
50962524 |
1 |
ON4C15H16 |
AB4C15D16 |
24.31 |
7.74 |
-8.63 |
-0.26 |
0 |
|
|
126383 |
50962947 |
1 |
N2O3C19H22 |
A2B3C19D22 |
-108.39 |
6.61 |
-8.69 |
-0.15 |
0 |
|
|
126384 |
50962948 |
1 |
ON5H21C23 |
AB5C21D23 |
118.1 |
3.82 |
-8.95 |
-0.96 |
0 |
|
|
126385 |
50962949 |
1 |
ON4C19H22 |
AB4C19D22 |
49.41 |
5.37 |
-9.02 |
0.19 |
0 |
|
|
126386 |
50962950 |
1 |
ClN3O3C17H18 |
AB3C3D17E18 |
-63.69 |
4.34 |
-8.91 |
-0.72 |
0 |
|
|
126387 |
50962967 |
1 |
OSN4C12H16 |
ABC4D12E16 |
69.17 |
6.66 |
-8.5 |
0.13 |
0 |
|
|
126388 |
50962968 |
1 |
ON5C18H25 |
AB5C18D25 |
9.94 |
5.25 |
-8.62 |
-0.51 |
0 |
|
|
126389 |
50962969 |
1 |
ON3H15C16 |
AB3C15D16 |
33.04 |
3.35 |
-9.12 |
-0.22 |
0 |
|
|
126390 |
50963208 |
1 |
ON7H17C19 |
AB7C17D19 |
127.68 |
9.39 |
-9.5 |
-1.44 |
0 |
|
|
126391 |
50963209 |
2 |
NO2C12H12 |
AB2C12D12 |
-60.52 |
7.45 |
-8.73 |
-0.85 |
0 |
|
|
126392 |
50963210 |
2 |
NO2H10C11 |
AB2C10D11 |
-93.01 |
1.1 |
-9.26 |
-0.38 |
0 |
|
|
126393 |
50963427 |
1 |
ClFON4H14C15 |
ABCD4E14F15 |
2.95 |
3.08 |
-9.21 |
-1.11 |
0 |
|
|
126394 |
50963622 |
1 |
ClON4C17H19 |
ABC4D17E19 |
29.52 |
6.22 |
-8.57 |
0.07 |
0 |
|
|
126395 |
50963659 |
1 |
ON6C18H24 |
AB6C18D24 |
30.41 |
3.15 |
-9.03 |
-1.05 |
0 |
|
|
126396 |
50963660 |
1 |
O2N6C17H18 |
A2B6C17D18 |
5.86 |
4.91 |
-8.87 |
-0.63 |
0 |
|
|
126397 |
50963661 |
4 |
NOC4H6 |
ABC4D6 |
-108.7 |
6.28 |
-9.65 |
-0.1 |
0 |
|
|
126398 |
50963726 |
1 |
ClO2N3C19H22 |
AB2C3D19E22 |
-66.87 |
9.19 |
-8.43 |
-0.49 |
0 |
|
|
126399 |
50963734 |
1 |
O2N4C19H22 |
A2B4C19D22 |
-8.51 |
5.38 |
-8.72 |
-0.33 |
0 |
|
|
126400 |
50963794 |
1 |
O2N5C17H19 |
A2B5C17D19 |
-44.77 |
6.29 |
-8.7 |
-0.51 |
0 |
|
|
126401 |
50963950 |
1 |
O2N5C18H19 |
A2B5C18D19 |
46.82 |
8.15 |
-9.14 |
-0.82 |
0 |
|
|
126402 |
50964049 |
1 |
N7C15H21 |
A7B15C21 |
106.29 |
1.23 |
-8.94 |
0.2 |
0 |
|
|
126403 |
50964050 |
2 |
ON2H8C10 |
AB2C8D10 |
56.45 |
8.61 |
-9.25 |
-1.09 |
0 |
|
|
126404 |
50964075 |
1 |
N2O3C16H26 |
A2B3C16D26 |
-99.17 |
1.3 |
-9.26 |
0.28 |
0 |
|
|
126405 |
50964077 |
1 |
ON4C19H20 |
AB4C19D20 |
37.08 |
5.95 |
-8.78 |
-0.58 |
0 |
|
|
126406 |
50964078 |
1 |
FON4C21H23 |
ABC4D21E23 |
-4.16 |
3.76 |
-9.03 |
-0.54 |
0 |
|
|
126407 |
50964079 |
1 |
O2N5H19C21 |
A2B5C19D21 |
52.17 |
9.32 |
-8.49 |
-0.71 |
0 |
|
|
126408 |
50964080 |
1 |
ON4C21H28 |
AB4C21D28 |
6.8 |
6.66 |
-8.51 |
0.19 |
0 |
|
|
126409 |
50964081 |
1 |
SN3O3C16H19 |
AB3C3D16E19 |
-44.14 |
4.57 |
-8.81 |
-0.75 |
0 |
|
|
126410 |
50964082 |
1 |
N2O4C19H24 |
A2B4C19D24 |
-118.25 |
7.0 |
-8.41 |
-0.17 |
0 |
|
|
126411 |
50964083 |
1 |
O2N3C21H25 |
A2B3C21D25 |
-20.92 |
3.83 |
-8.89 |
-0.79 |
0 |
|
|
126412 |
50964084 |
1 |
ClO2N3C17H22 |
AB2C3D17E22 |
-45.06 |
1.54 |
-8.77 |
0.19 |
0 |
|
|
126413 |
50964085 |
1 |
O2N4C19H20 |
A2B4C19D20 |
-18.75 |
7.88 |
-8.5 |
-1.5 |
0 |
|
|
126414 |
50964087 |
1 |
N4C13H16 |
A4B13C16 |
63.16 |
4.4 |
-8.59 |
-0.38 |
0 |
|
|
126415 |
50964143 |
1 |
ON6C21H22 |
AB6C21D22 |
58.89 |
4.31 |
-9.0 |
-0.82 |
0 |
|
|
126416 |
50964165 |
1 |
N3O3H19C22 |
A3B3C19D22 |
-41.02 |
6.62 |
-9.01 |
-1.44 |
0 |
|
|
126417 |
50964166 |
1 |
O2N4C17H26 |
A2B4C17D26 |
-73.08 |
3.37 |
-8.64 |
0.07 |
0 |
|
|
126418 |
50964301 |
1 |
ON5C19H33 |
AB5C19D33 |
-53.57 |
4.41 |
-8.73 |
0.08 |
0 |
|
|
126419 |
50964330 |
1 |
N2F3O4H15C16 |
A2B3C4D15E16 |
-277.94 |
4.98 |
-9.78 |
-0.51 |
0 |
|
|
126420 |
50964331 |
1 |
SN8C16H16 |
AB8C16D16 |
175.76 |
10.5 |
-9.27 |
-1.38 |
0 |
|
|
126421 |
50964332 |
1 |
NO3C17H23 |
AB3C17D23 |
-67.9 |
2.81 |
-8.73 |
-0.04 |
0 |
|
|
126422 |
50964333 |
1 |
N2O3C18H22 |
A2B3C18D22 |
-109.97 |
5.47 |
-9.32 |
-1.18 |
0 |
|
|
126423 |
50964529 |
1 |
SO2N4C17H18 |
AB2C4D17E18 |
14.37 |
1.46 |
-9.15 |
-0.73 |
0 |
|
|
126424 |
50964542 |
1 |
NF2O5H19C20 |
AB2C5D19E20 |
-235.24 |
4.82 |
-8.91 |
-0.77 |
0 |
|
|
126425 |
50964595 |
1 |
N2O4C19H26 |
A2B4C19D26 |
-149.94 |
5.17 |
-8.42 |
0.01 |
0 |
|
|
126426 |
50964612 |
1 |
ON5C13H13 |
AB5C13D13 |
65.51 |
2.47 |
-9.5 |
-0.35 |
0 |
|
|
126427 |
50964613 |
1 |
ClN2O2C16H23 |
AB2C2D16E23 |
-73.44 |
5.26 |
-8.62 |
0.1 |
0 |
|
|
126428 |
50964614 |
1 |
ClN2O3C17H25 |
AB2C3D17E25 |
-129.07 |
3.01 |
-9.06 |
-0.25 |
0 |
|
|
126429 |
50964728 |
1 |
FO2N4C17H19 |
AB2C4D17E19 |
-55.86 |
4.81 |
-9.49 |
-0.73 |
0 |
|
|
126430 |
50964809 |
1 |
N5C21H21 |
A5B21C21 |
122.32 |
5.71 |
-8.88 |
-0.49 |
0 |
|
|
126431 |
50964810 |
7 |
NC2H3 |
AB2C3 |
78.47 |
6.07 |
-8.86 |
-0.02 |
0 |
|
|
126432 |
50964867 |
1 |
ClN5H16C19 |
AB5C16D19 |
118.02 |
4.88 |
-8.62 |
-0.67 |
0 |
|
|
126433 |
50964923 |
1 |
O2N5H19C21 |
A2B5C19D21 |
13.44 |
3.99 |
-9.18 |
-0.81 |
0 |
|
|
126434 |
50964924 |
1 |
N3O3C20H25 |
A3B3C20D25 |
-103.69 |
6.45 |
-8.39 |
-0.31 |
0 |
|
|
126435 |
50964925 |
1 |
O2N4C21H24 |
A2B4C21D24 |
-29.39 |
5.21 |
-8.76 |
-0.78 |
0 |