List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
346334 |
127270838 |
1 |
SO3N5C18H27 |
AB3C5D18E27 |
-120.36 |
7.46 |
-9.25 |
-0.62 |
0 |
|
|
346335 |
127270839 |
1 |
SO2N3C15H21 |
AB2C3D15E21 |
-62.81 |
2.71 |
-9.51 |
-0.73 |
0 |
|
|
346336 |
127270840 |
1 |
SO2N5C19H21 |
AB2C5D19E21 |
-19.9 |
6.99 |
-9.42 |
-1.29 |
0 |
|
|
346337 |
127270841 |
1 |
SO3N5C14H19 |
AB3C5D14E19 |
-96.6 |
6.96 |
-9.29 |
-0.69 |
0 |
|
|
346338 |
127270842 |
2 |
ON2C10H11 |
AB2C10D11 |
5.06 |
5.89 |
-8.59 |
-0.84 |
0 |
|
|
346339 |
127270843 |
1 |
ON3C15H19 |
AB3C15D19 |
-16.02 |
6.02 |
-8.85 |
-0.78 |
0 |
|
|
346340 |
127270844 |
1 |
SO3N4C20H22 |
AB3C4D20E22 |
-52.0 |
9.8 |
-9.14 |
-1.28 |
0 |
|
|
346341 |
127270845 |
1 |
SO3N4C20H22 |
AB3C4D20E22 |
-50.56 |
5.17 |
-8.91 |
-0.76 |
0 |
|
|
346342 |
127270846 |
2 |
ON2C10H14 |
AB2C10D14 |
-48.27 |
5.45 |
-8.82 |
-0.79 |
0 |
|
|
346343 |
127270847 |
1 |
ON4C20H22 |
AB4C20D22 |
34.73 |
5.36 |
-8.88 |
-0.72 |
0 |
|
|
346344 |
127270848 |
2 |
ON2C10H13 |
AB2C10D13 |
-55.26 |
5.98 |
-8.82 |
-0.67 |
0 |
|
|
346345 |
127270849 |
1 |
ON4C21H24 |
AB4C21D24 |
28.37 |
5.56 |
-8.79 |
-0.78 |
0 |
|
|
346346 |
127270850 |
1 |
ClOSN4C18H19 |
ABCD4E18F19 |
39.16 |
5.16 |
-8.97 |
-0.84 |
0 |
|
|
346347 |
127270851 |
1 |
OSN4C18H20 |
ABC4D18E20 |
42.25 |
5.13 |
-8.91 |
-0.8 |
0 |
|
|
346348 |
127270852 |
1 |
ON6C20H20 |
AB6C20D20 |
77.05 |
4.86 |
-8.87 |
-0.99 |
0 |
|
|
346349 |
127270853 |
1 |
N3O3C13H19 |
A3B3C13D19 |
-124.92 |
1.65 |
-9.63 |
0.26 |
0 |
|
|
346350 |
127270854 |
2 |
ON2C9H13 |
AB2C9D13 |
-50.41 |
7.45 |
-8.88 |
-0.83 |
0 |
|
|
346351 |
127270855 |
1 |
O2N3C20H21 |
A2B3C20D21 |
-11.24 |
5.52 |
-8.71 |
-0.63 |
0 |
|
|
346352 |
127270856 |
2 |
NO2C11H15 |
AB2C11D15 |
-168.69 |
3.56 |
-8.66 |
0.07 |
0 |
|
|
346353 |
127270857 |
3 |
NOC7H7 |
ABC7D7 |
-43.98 |
7.06 |
-8.71 |
-0.64 |
0 |
|
|
346354 |
127270858 |
1 |
O2N5C21H29 |
A2B5C21D29 |
-42.43 |
8.67 |
-8.83 |
-0.79 |
0 |
|
|
346355 |
127270859 |
1 |
ON4C20H22 |
AB4C20D22 |
31.9 |
4.97 |
-8.41 |
-0.73 |
0 |
|
|
346356 |
127270860 |
1 |
N3O3C20H33 |
A3B3C20D33 |
-173.92 |
4.39 |
-9.27 |
0.7 |
0 |
|
|
346357 |
127270861 |
1 |
O2N4C19H24 |
A2B4C19D24 |
-48.22 |
5.67 |
-8.82 |
-0.66 |
0 |
|
|
346358 |
127270862 |
1 |
O2N5C19H25 |
A2B5C19D25 |
-19.44 |
5.14 |
-9.01 |
-0.86 |
0 |
|
|
346359 |
127270863 |
1 |
O2N4C19H28 |
A2B4C19D28 |
-61.33 |
5.92 |
-8.89 |
-0.9 |
0 |
|
|
346360 |
127270864 |
1 |
SO3N4C20H22 |
AB3C4D20E22 |
-45.89 |
5.41 |
-8.97 |
-0.8 |
0 |
|
|
346361 |
127270865 |
1 |
O2N3C20H21 |
A2B3C20D21 |
-9.89 |
5.88 |
-8.84 |
-0.6 |
0 |
|
|
346362 |
127270866 |
1 |
S2N3O5C14H17 |
A2B3C5D14E17 |
-143.01 |
6.53 |
-9.28 |
-1.09 |
0 |
|
|
346363 |
127270867 |
1 |
O3N4C19H24 |
A3B4C19D24 |
-83.09 |
4.85 |
-9.03 |
-0.88 |
0 |
|
|
346364 |
127270868 |
1 |
O2N4C15H18 |
A2B4C15D18 |
-40.3 |
5.41 |
-8.82 |
-0.78 |
0 |
|
|
346365 |
127270869 |
1 |
O2N7C15H17 |
A2B7C15D17 |
30.91 |
2.53 |
-8.86 |
-0.55 |
0 |
|
|
346366 |
127270870 |
1 |
O2N3C21H31 |
A2B3C21D31 |
-84.25 |
1.35 |
-8.61 |
0.29 |
0 |
|
|
346367 |
127270871 |
1 |
ON4C20H22 |
AB4C20D22 |
38.55 |
5.72 |
-8.75 |
-0.84 |
0 |
|
|
346368 |
127270872 |
1 |
O2N5C15H19 |
A2B5C15D19 |
-15.37 |
4.11 |
-8.2 |
-0.59 |
0 |
|
|
346369 |
127270873 |
1 |
ON6C19H22 |
AB6C19D22 |
48.16 |
6.35 |
-8.29 |
-1.09 |
0 |
|
|
346370 |
127270874 |
1 |
SN3O3C14H17 |
AB3C3D14E17 |
-90.43 |
4.79 |
-9.13 |
-1.14 |
0 |
|
|
346371 |
127270875 |
1 |
FON4C21H23 |
ABC4D21E23 |
-12.83 |
4.5 |
-9.0 |
-0.85 |
0 |
|
|
346372 |
127270876 |
1 |
SN3O4C20H21 |
AB3C4D20E21 |
-80.29 |
5.08 |
-9.09 |
-1.34 |
0 |
|
|
346373 |
127270877 |
2 |
ON2C9H11 |
AB2C9D11 |
-29.46 |
3.86 |
-8.99 |
-0.95 |
0 |
|
|
346374 |
127270878 |
1 |
OF3N3C16H18 |
AB3C3D16E18 |
-177.94 |
5.93 |
-8.98 |
-0.94 |
0 |
|
|
346375 |
127270879 |
1 |
N3O3C12H19 |
A3B3C12D19 |
-141.24 |
3.82 |
-9.32 |
0.05 |
0 |
|
|
346376 |
127270880 |
1 |
SO4N5C17H23 |
AB4C5D17E23 |
-106.23 |
4.2 |
-9.04 |
-0.86 |
0 |
|
|
346377 |
127270881 |
1 |
O2N5C20H27 |
A2B5C20D27 |
-54.34 |
3.8 |
-8.98 |
-0.84 |
0 |
|
|
346378 |
127270882 |
1 |
SN3O3C20H23 |
AB3C3D20E23 |
-51.06 |
4.52 |
-8.59 |
-1.22 |
0 |
|
|
346379 |
127270883 |
1 |
O2N3C19H33 |
A2B3C19D33 |
-126.42 |
3.14 |
-8.65 |
0.59 |
0 |
|
|
346380 |
127270884 |
1 |
O2N4C21H28 |
A2B4C21D28 |
-56.24 |
2.71 |
-9.01 |
-0.92 |
0 |
|
|
346381 |
127270885 |
2 |
ON2C11H12 |
AB2C11D12 |
-16.01 |
3.07 |
-9.01 |
-0.85 |
0 |
|
|
346382 |
127270886 |
1 |
O2N3C14H17 |
A2B3C14D17 |
-47.37 |
4.2 |
-9.01 |
-0.85 |
0 |
|
|
346383 |
127270887 |
2 |
ON2C8H11 |
AB2C8D11 |
-40.78 |
6.43 |
-8.86 |
-0.88 |
0 |
|
|
346384 |
127270888 |
1 |
O3N4C12H18 |
A3B4C12D18 |
-92.42 |
2.81 |
-9.03 |
-0.33 |
0 |
|
|
346385 |
127270889 |
1 |
O2N4C23H26 |
A2B4C23D26 |
-22.69 |
4.85 |
-8.94 |
-0.95 |
0 |
|
|
346386 |
127270890 |
1 |
O2N3C15H19 |
A2B3C15D19 |
-51.89 |
6.15 |
-8.8 |
-0.74 |
0 |
|
|
346387 |
127270891 |
1 |
O2N4C21H28 |
A2B4C21D28 |
-60.55 |
6.41 |
-8.85 |
-0.63 |
0 |
|
|
346388 |
127270892 |
1 |
O2N4C19H26 |
A2B4C19D26 |
-58.26 |
5.49 |
-8.81 |
-0.65 |
0 |
|
|
346389 |
127270893 |
1 |
O2N5C20H27 |
A2B5C20D27 |
-41.82 |
6.42 |
-8.86 |
-0.7 |
0 |
|
|
346390 |
127270894 |
1 |
ON4C17H24 |
AB4C17D24 |
-9.09 |
6.79 |
-8.76 |
-0.7 |
0 |
|
|
346391 |
127270895 |
1 |
O3N4C15H20 |
A3B4C15D20 |
-44.75 |
5.52 |
-8.95 |
-0.35 |
0 |
|
|
346392 |
127270896 |
1 |
SN3O3C19H21 |
AB3C3D19E21 |
-53.27 |
3.3 |
-8.68 |
-1.16 |
0 |
|
|
346393 |
127270897 |
1 |
O2N3C18H31 |
A2B3C18D31 |
-125.96 |
3.39 |
-8.89 |
0.9 |
0 |
|
|
346394 |
127270898 |
1 |
SN3O4H17C19 |
AB3C4D17E19 |
-30.51 |
7.3 |
-9.13 |
-1.32 |
0 |
|
|
346395 |
127270899 |
3 |
NOC6H9 |
ABC6D9 |
-102.34 |
5.33 |
-9.88 |
0.03 |
0 |
|
|
346396 |
127270900 |
1 |
O2N4C17H18 |
A2B4C17D18 |
19.71 |
4.67 |
-9.03 |
-0.75 |
0 |
|
|
346397 |
127270901 |
1 |
N2O2C15H22 |
A2B2C15D22 |
-82.29 |
2.12 |
-9.13 |
-0.12 |
0 |
|
|
346398 |
127270902 |
1 |
ON4C17H24 |
AB4C17D24 |
-7.6 |
6.51 |
-8.76 |
-0.71 |
0 |
|
|
346399 |
127270903 |
1 |
OSN5C19H27 |
ABC5D19E27 |
3.1 |
4.95 |
-8.4 |
-0.76 |
0 |
|
|
346400 |
127270904 |
1 |
OSN5C21H27 |
ABC5D21E27 |
24.03 |
5.58 |
-8.77 |
-0.73 |
0 |
|
|
346401 |
127270905 |
1 |
SN2O2C10H14 |
AB2C2D10E14 |
-55.89 |
3.2 |
-8.56 |
-0.37 |
0 |
|
|
346402 |
127270906 |
1 |
F2O2N3H19C20 |
A2B2C3D19E20 |
-101.79 |
4.04 |
-9.0 |
-0.84 |
0 |
|
|
346403 |
127270907 |
1 |
O2N3C22H25 |
A2B3C22D25 |
-29.77 |
5.89 |
-8.64 |
-0.71 |
0 |
|
|
346404 |
127270908 |
1 |
O2N5C22H25 |
A2B5C22D25 |
-5.04 |
7.02 |
-8.96 |
-0.8 |
0 |
|
|
346405 |
127270909 |
2 |
ON2C8H10 |
AB2C8D10 |
-53.06 |
3.77 |
-9.06 |
-0.82 |
0 |
|
|
346406 |
127270910 |
2 |
ON2C8H10 |
AB2C8D10 |
-50.19 |
8.11 |
-8.92 |
-0.72 |
0 |
|
|
346407 |
127270911 |
1 |
O3N4C22H24 |
A3B4C22D24 |
-49.6 |
6.24 |
-9.07 |
-0.83 |
0 |
|
|
346408 |
127270912 |
1 |
O2N5C21H23 |
A2B5C21D23 |
-17.63 |
5.69 |
-8.95 |
-0.76 |
0 |