List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
436303 |
135198529 |
1 |
BrSN2C9H17 |
ABC2D9E17 |
29.27 |
4.43 |
-8.77 |
-0.4 |
0 |
|
|
436304 |
135198563 |
1 |
F3O3N7C25H32 |
A3B3C7D25E32 |
-200.76 |
5.34 |
-8.43 |
-0.15 |
0 |
|
|
436305 |
135198588 |
1 |
O2N5C22H29 |
A2B5C22D29 |
-5.86 |
5.58 |
-8.28 |
-0.2 |
0 |
|
|
436306 |
135198596 |
1 |
ClIN3O4C15H15 |
ABC3D4E15F15 |
-112.15 |
6.89 |
-9.14 |
-1.0 |
0 |
|
|
436307 |
135198605 |
1 |
BrO5N6C23H29 |
AB5C6D23E29 |
-146.21 |
5.51 |
-8.58 |
-0.76 |
0 |
|
|
436308 |
135198616 |
1 |
BrSO3N6C21H39 |
ABC3D6E21F39 |
-103.04 |
8.38 |
-8.38 |
-0.54 |
0 |
|
|
436309 |
135198702 |
1 |
ClO2N5C21H24 |
AB2C5D21E24 |
1.06 |
5.08 |
-8.91 |
-0.46 |
0 |
|
|
436310 |
135198703 |
1 |
ClSO2N6C20H31 |
ABC2D6E20F31 |
-30.23 |
6.03 |
-8.49 |
-0.26 |
0 |
|
|
436311 |
135198770 |
1 |
OPN2C9H21 |
ABC2D9E21 |
-97.37 |
4.82 |
-8.26 |
2.39 |
0 |
|
|
436312 |
135198808 |
1 |
NC16H35 |
AB16C35 |
-46.46 |
1.45 |
-8.65 |
3.24 |
0 |
|
|
436313 |
135198828 |
1 |
ClON7C20H28 |
ABC7D20E28 |
37.84 |
6.88 |
-8.49 |
-0.17 |
0 |
|
|
436314 |
135198832 |
1 |
ClO3N7C24H28 |
AB3C7D24E28 |
-43.33 |
5.28 |
-8.65 |
-1.24 |
0 |
|
|
436315 |
135198871 |
1 |
N4H42C53 |
A4B42C53 |
253.28 |
4.45 |
-8.34 |
-0.9 |
0 |
|
|
436316 |
135198872 |
1 |
N3H49C64 |
A3B49C64 |
389.17 |
7.25 |
-8.41 |
-0.85 |
0 |
|
|
436317 |
135198874 |
1 |
N3H55C59 |
A3B55C59 |
240.39 |
0.66 |
-8.37 |
-0.77 |
0 |
|
|
436318 |
135198875 |
1 |
N2H46C59 |
A2B46C59 |
294.61 |
4.76 |
-7.88 |
-0.92 |
0 |
|
|
436319 |
135198895 |
2 |
N2H13C20 |
A2B13C20 |
226.41 |
5.1 |
-8.36 |
-1.11 |
0 |
|
|
436320 |
135198896 |
1 |
N3H31C51 |
A3B31C51 |
253.86 |
3.46 |
-8.64 |
-1.05 |
0 |
|
|
436321 |
135198899 |
1 |
N3H39C55 |
A3B39C55 |
243.97 |
3.41 |
-7.86 |
-0.94 |
0 |
|
|
436322 |
135198951 |
1 |
NC10H15 |
AB10C15 |
39.4 |
2.15 |
-8.74 |
0.34 |
0 |
|
|
436323 |
135198958 |
1 |
ON3H51C56 |
AB3C51D56 |
240.27 |
2.19 |
-7.7 |
-0.79 |
0 |
|
|
436324 |
135198983 |
1 |
N2H28C35 |
A2B28C35 |
204.13 |
4.07 |
-8.16 |
-1.08 |
0 |
|
|
436325 |
135198987 |
1 |
SN3H31C53 |
AB3C31D53 |
257.26 |
4.79 |
-8.39 |
-1.24 |
0 |
|
|
436326 |
135198990 |
1 |
NOH23C26 |
ABC23D26 |
85.83 |
2.57 |
-8.57 |
-0.89 |
0 |
|
|
436327 |
135199001 |
1 |
SN3H49C52 |
AB3C49D52 |
193.8 |
3.38 |
-8.16 |
-1.07 |
0 |
|
|
436328 |
135199060 |
1 |
BrClOH10C12 |
ABCD10E12 |
-0.83 |
1.54 |
-9.51 |
-1.08 |
0 |
|
|
436329 |
135199065 |
1 |
BrNOC34H34 |
ABCD34E34 |
61.62 |
2.91 |
-8.78 |
-1.03 |
0 |
|
|
436330 |
135199068 |
1 |
FOC12H17 |
ABC12D17 |
-103.98 |
2.44 |
-9.44 |
-0.06 |
0 |
|
|
436332 |
135199097 |
1 |
N2O3C10H14 |
A2B3C10D14 |
-114.72 |
3.18 |
-10.2 |
-0.7 |
0 |
|
|
436333 |
135199100 |
1 |
FNO5C23H36 |
ABC5D23E36 |
-303.85 |
3.69 |
-8.97 |
0.1 |
0 |
|
|
436334 |
135199101 |
1 |
FNO4C23H36 |
ABC4D23E36 |
-273.97 |
1.47 |
-9.34 |
0.04 |
0 |
|
|
436335 |
135199102 |
3 |
NH11C18 |
AB11C18 |
264.81 |
4.5 |
-8.68 |
-1.02 |
0 |
|
|
436336 |
135199103 |
1 |
FN2O6C25H33 |
AB2C6D25E33 |
-275.75 |
8.23 |
-9.1 |
-0.83 |
0 |
|
|
436337 |
135199104 |
1 |
NOH31C40 |
ABC31D40 |
188.66 |
1.83 |
-8.42 |
-0.58 |
0 |
|
|
436338 |
135199112 |
1 |
FN2O6C26H31 |
AB2C6D26E31 |
-256.89 |
5.38 |
-9.31 |
-1.05 |
0 |
|
|
436339 |
135199113 |
1 |
N3H53C64 |
A3B53C64 |
280.27 |
3.14 |
-8.76 |
-0.94 |
0 |
|
|
436340 |
135199114 |
1 |
N3H63C65 |
A3B63C65 |
284.58 |
5.15 |
-7.69 |
-0.74 |
0 |
|
|
436341 |
135199158 |
1 |
FON5H14C15 |
ABC5D14E15 |
38.34 |
1.63 |
-8.76 |
-1.43 |
0 |
|
|
436342 |
135199165 |
1 |
N2O5C23H28 |
A2B5C23D28 |
-154.89 |
3.29 |
-9.03 |
-1.01 |
0 |
|
|
436343 |
135199170 |
1 |
N2O5C26H34 |
A2B5C26D34 |
-194.4 |
7.7 |
-8.85 |
-0.73 |
0 |
|
|
436344 |
135199185 |
1 |
N3H45C53 |
A3B45C53 |
237.8 |
5.47 |
-8.46 |
-0.85 |
0 |
|
|
436345 |
135199190 |
1 |
N6H20C25 |
A6B20C25 |
153.55 |
5.11 |
-8.53 |
-0.94 |
0 |
|
|
436346 |
135199211 |
1 |
NC37H45 |
AB37C45 |
103.66 |
3.7 |
-8.56 |
-0.36 |
0 |
|
|
436347 |
135199213 |
1 |
N2O6C27H36 |
A2B6C27D36 |
-240.32 |
8.09 |
-9.05 |
-0.83 |
0 |
|
|
436348 |
135199215 |
1 |
N2C13H16 |
A2B13C16 |
60.17 |
1.78 |
-8.64 |
-0.09 |
0 |
|
|
436349 |
135199216 |
1 |
NH35C39 |
AB35C39 |
168.1 |
3.17 |
-8.79 |
-0.63 |
0 |
|
|
436350 |
135199219 |
1 |
N2O5C24H32 |
A2B5C24D32 |
-199.1 |
1.07 |
-9.14 |
-0.94 |
0 |
|
|
436351 |
135199279 |
1 |
SN5H31C43 |
AB5C31D43 |
339.15 |
4.01 |
-8.15 |
-1.1 |
0 |
|
|
436352 |
135199288 |
1 |
NF2O4C20H29 |
AB2C4D20E29 |
-305.0 |
3.55 |
-9.71 |
-0.34 |
0 |
|
|
436353 |
135199319 |
1 |
FNO5C24H36 |
ABC5D24E36 |
-305.89 |
5.62 |
-9.15 |
-0.16 |
0 |
|
|
436354 |
135199321 |
1 |
FN2O6C28H37 |
AB2C6D28E37 |
-291.71 |
3.65 |
-9.22 |
-1.04 |
0 |
|
|
436355 |
135199333 |
1 |
FN2O6C28H37 |
AB2C6D28E37 |
-293.19 |
6.79 |
-9.21 |
-1.02 |
0 |
|
|
436356 |
135199335 |
1 |
N2O7C27H34 |
A2B7C27D34 |
-269.86 |
4.83 |
-9.31 |
-0.97 |
0 |
|
|
436357 |
135199336 |
1 |
NOH17C26 |
ABC17D26 |
78.66 |
2.75 |
-8.73 |
-1.08 |
0 |
|
|
436358 |
135199338 |
1 |
N2O7C25H32 |
A2B7C25D32 |
-261.88 |
6.36 |
-8.82 |
-0.83 |
0 |
|
|
436359 |
135199339 |
1 |
ON3H33C49 |
AB3C33D49 |
201.12 |
4.85 |
-8.36 |
-1.04 |
0 |
|
|
436360 |
135199341 |
1 |
ON3H31C45 |
AB3C31D45 |
221.21 |
3.96 |
-8.78 |
-1.17 |
0 |
|
|
436361 |
135199342 |
1 |
FNO5C21H32 |
ABC5D21E32 |
-296.11 |
2.3 |
-8.76 |
0.0 |
0 |
|
|
436362 |
135199343 |
1 |
ON4H40C49 |
AB4C40D49 |
194.13 |
6.19 |
-8.41 |
-0.79 |
0 |
|
|
436363 |
135199377 |
1 |
FN2O7C25H31 |
AB2C7D25E31 |
-303.74 |
10.77 |
-8.89 |
-0.74 |
0 |
|
|
436364 |
135199379 |
2 |
NO4C13H17 |
AB4C13D17 |
-300.56 |
4.89 |
-8.36 |
-1.04 |
0 |
|
|
436365 |
135199380 |
1 |
FNO4C21H32 |
ABC4D21E32 |
-269.62 |
4.47 |
-9.33 |
0.07 |
0 |
|
|
436366 |
135199381 |
1 |
N2O7C23H28 |
A2B7C23D28 |
-243.64 |
4.92 |
-8.63 |
-0.75 |
0 |
|
|
436367 |
135199392 |
2 |
NH24C27 |
AB24C27 |
151.44 |
3.87 |
-7.76 |
-0.36 |
0 |
|
|
436368 |
135199395 |
1 |
FNO5C23H36 |
ABC5D23E36 |
-306.53 |
2.68 |
-9.01 |
-0.04 |
0 |
|
|
436369 |
135199410 |
1 |
FN2O6C24H29 |
AB2C6D24E29 |
-269.08 |
6.67 |
-9.06 |
-1.01 |
0 |
|
|
436370 |
135199426 |
1 |
N2O5C23H30 |
A2B5C23D30 |
-198.23 |
1.16 |
-9.13 |
-0.92 |
0 |
|
|
436371 |
135199459 |
1 |
NO5C22H35 |
AB5C22D35 |
-261.16 |
0.87 |
-8.46 |
0.52 |
0 |
|
|
436372 |
135199460 |
1 |
NO4C22H35 |
AB4C22D35 |
-219.3 |
4.16 |
-9.52 |
0.2 |
0 |
|
|
436373 |
135199461 |
1 |
FSN2O5C25H31 |
ABC2D5E25F31 |
-225.95 |
6.76 |
-8.78 |
-0.91 |
0 |
|
|
436374 |
135199506 |
1 |
FN2O7C29H37 |
AB2C7D29E37 |
-325.01 |
8.55 |
-8.93 |
-0.88 |
0 |
|
|
436375 |
135199508 |
1 |
FN2O6C23H29 |
AB2C6D23E29 |
-277.35 |
2.13 |
-8.95 |
-0.97 |
0 |
|
|
436376 |
135199512 |
1 |
N2O7C30H40 |
A2B7C30D40 |
-293.7 |
3.01 |
-8.76 |
-0.75 |
0 |
|
|
436377 |
135199515 |
1 |
FN2O7C30H41 |
AB2C7D30E41 |
-330.9 |
2.63 |
-9.26 |
-0.95 |
0 |
|
|
436378 |
135199566 |
1 |
ClNO3C17H20 |
ABC3D17E20 |
-36.49 |
5.95 |
-9.6 |
-0.3 |
0 |
|
|
436379 |
135199582 |
1 |
N4O5C32H36 |
A4B5C32D36 |
-135.46 |
3.04 |
-8.43 |
-1.02 |
0 |
|
|
436380 |
135199594 |
1 |
N2O3H24C25 |
A2B3C24D25 |
-46.51 |
5.71 |
-8.38 |
-0.4 |
0 |
|
|
436381 |
135199611 |
1 |
N3O4C22H27 |
A3B4C22D27 |
-139.22 |
8.85 |
-9.31 |
-0.11 |
0 |
|
|
436382 |
135199624 |
1 |
SN5O8C44H65 |
AB5C8D44E65 |
-363.02 |
4.62 |
-8.37 |
-0.37 |
0 |
|
|
436383 |
135199628 |
1 |
Cl2O7H16C23 |
A2B7C16D23 |
-209.01 |
7.85 |
-8.74 |
-1.01 |
0 |
|
|
436384 |
135199638 |
2 |
NO3C9H17 |
AB3C9D17 |
-305.96 |
4.66 |
-9.79 |
0.87 |
0 |
|
|
436385 |
135199656 |
1 |
N2O3H22C24 |
A2B3C22D24 |
-65.44 |
5.26 |
-8.75 |
-0.48 |
0 |
|
|
436386 |
135199657 |
1 |
Cl2O7H20C25 |
A2B7C20D25 |
-219.13 |
7.98 |
-8.73 |
-0.94 |
0 |
|
|
436387 |
135199658 |
1 |
F6N7O9C61H61 |
A6B7C9D61E61 |
-585.41 |
6.48 |
-8.57 |
-1.46 |
0 |
|
|
436388 |
135199683 |
2 |
NH11C16 |
AB11C16 |
168.32 |
3.85 |
-8.18 |
-0.95 |
0 |
|
|
436389 |
135199696 |
1 |
N7O7C55H59 |
A7B7C55D59 |
-198.97 |
6.83 |
-8.51 |
-1.0 |
0 |
|
|
436390 |
135199699 |
1 |
SN5O9C42H61 |
AB5C9D42E61 |
-375.32 |
5.56 |
-8.38 |
-0.44 |
0 |
|
|
436391 |
135199703 |
1 |
SF4N4O5C39H44 |
AB4C4D5E39F44 |
-340.43 |
4.62 |
-8.41 |
-1.18 |
0 |
|
|
436392 |
135199747 |
1 |
N4O7C21H34 |
A4B7C21D34 |
-294.13 |
7.97 |
-9.82 |
-1.71 |
0 |
|
|
436393 |
135199752 |
1 |
Cl2N5O11C59H63 |
A2B5C11D59E63 |
-366.75 |
3.86 |
-8.55 |
-1.36 |
0 |
|
|
436394 |
135199823 |
1 |
O6N7C25H31 |
A6B7C25D31 |
-164.67 |
3.23 |
-9.26 |
-1.66 |
0 |
|
|
436395 |
135199824 |
1 |
PO5N7C43H46 |
AB5C7D43E46 |
-107.22 |
6.5 |
-8.72 |
-0.67 |
0 |
|
|
436396 |
135199825 |
1 |
N5O8C26H41 |
A5B8C26D41 |
-392.63 |
1.61 |
-8.99 |
-0.83 |
0 |
|
|
436397 |
135199851 |
1 |
N6O7C32H48 |
A6B7C32D48 |
-314.89 |
2.71 |
-9.06 |
-0.91 |
0 |
|
|
436398 |
135199858 |
1 |
N2S3O4C8H16 |
A2B3C4D8E16 |
-181.49 |
1.1 |
-9.76 |
-2.27 |
0 |
|
|
436399 |
135199859 |
1 |
N2O9C22H38 |
A2B9C22D38 |
-471.38 |
5.45 |
-10.28 |
-0.24 |
0 |
|
|
436400 |
135199861 |
1 |
N2O7C13H22 |
A2B7C13D22 |
-349.46 |
4.53 |
-10.11 |
0.07 |
0 |
|
|
436401 |
135199877 |
1 |
N8O11C33H42 |
A8B11C33D42 |
-422.34 |
5.49 |
-9.96 |
-1.82 |
0 |
|
|
436402 |
135199924 |
1 |
OSN2C17H24 |
ABC2D17E24 |
-25.74 |
3.38 |
-8.68 |
0.13 |
0 |
|
|
436403 |
135199938 |
1 |
N3C13H23 |
A3B13C23 |
24.07 |
2.62 |
-9.1 |
0.8 |
0 |