List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
419444 |
135108190 |
1 |
ClN2O5C17H21 |
AB2C5D17E21 |
-186.31 |
3.71 |
-9.72 |
-0.88 |
0 |
|
|
419445 |
135108191 |
1 |
NSO3C16H21 |
ABC3D16E21 |
-71.17 |
2.47 |
-8.87 |
-0.08 |
0 |
|
|
419446 |
135108192 |
1 |
SO2N4C17H26 |
AB2C4D17E26 |
-70.81 |
6.07 |
-8.81 |
-0.53 |
0 |
|
|
419447 |
135108193 |
1 |
FN6C11H15 |
AB6C11D15 |
37.09 |
5.27 |
-8.62 |
0.0 |
0 |
|
|
419448 |
135108194 |
1 |
O3N4C17H20 |
A3B4C17D20 |
-62.01 |
6.49 |
-8.86 |
-1.35 |
0 |
|
|
419449 |
135108195 |
1 |
O3N4C18H20 |
A3B4C18D20 |
-33.34 |
7.23 |
-9.2 |
-0.88 |
0 |
|
|
419450 |
135108196 |
1 |
SO5N6C33H52 |
AB5C6D33E52 |
-239.23 |
3.69 |
-8.73 |
0.11 |
0 |
|
|
419451 |
135108197 |
1 |
N7O8C39H55 |
A7B8C39D55 |
-296.49 |
11.0 |
-8.31 |
-0.09 |
0 |
|
|
419452 |
135108198 |
1 |
N3O3C22H25 |
A3B3C22D25 |
-24.41 |
4.78 |
-8.96 |
-0.84 |
0 |
|
|
419453 |
135108199 |
1 |
O2N5C17H17 |
A2B5C17D17 |
-11.0 |
2.45 |
-9.28 |
-0.84 |
0 |
|
|
419454 |
135108200 |
1 |
N3O3C21H29 |
A3B3C21D29 |
-92.42 |
6.03 |
-8.54 |
0.42 |
0 |
|
|
419455 |
135108201 |
1 |
ON3C21H29 |
AB3C21D29 |
-23.35 |
3.76 |
-8.38 |
0.32 |
0 |
|
|
419456 |
135108202 |
1 |
SN4O6C14H22 |
AB4C6D14E22 |
-252.35 |
6.03 |
-9.66 |
-0.94 |
0 |
|
|
419457 |
135108203 |
1 |
NS2O5C12H17 |
AB2C5D12E17 |
-206.11 |
10.76 |
-9.88 |
-0.9 |
0 |
|
|
419458 |
135108204 |
1 |
ON4C17H28 |
AB4C17D28 |
-55.15 |
3.65 |
-8.16 |
0.56 |
0 |
|
|
419459 |
135108205 |
1 |
NSO4C15H21 |
ABC4D15E21 |
-173.95 |
6.03 |
-9.51 |
-0.54 |
0 |
|
|
419460 |
135108206 |
1 |
NO2C18H25 |
AB2C18D25 |
-103.95 |
4.12 |
-9.23 |
0.07 |
0 |
|
|
419461 |
135108239 |
1 |
O2N4C17H24 |
A2B4C17D24 |
-68.83 |
5.46 |
-8.9 |
-0.34 |
0 |
|
|
419462 |
135108240 |
1 |
NO4C18H21 |
AB4C18D21 |
-122.3 |
4.7 |
-9.26 |
-0.1 |
0 |
|
|
419463 |
135108244 |
1 |
N3O3C18H25 |
A3B3C18D25 |
-84.7 |
4.08 |
-9.59 |
-0.68 |
0 |
|
|
419464 |
135108245 |
1 |
SF2N7O7C36H43 |
AB2C7D7E36F43 |
-325.58 |
5.68 |
-9.28 |
-1.12 |
0 |
|
|
419465 |
135108246 |
1 |
O2N6C19H28 |
A2B6C19D28 |
-37.56 |
8.36 |
-8.44 |
0.38 |
0 |
|
|
419466 |
135108247 |
1 |
O2F3N3C17H20 |
A2B3C3D17E20 |
-200.71 |
1.46 |
-9.01 |
-0.28 |
0 |
|
|
419467 |
135108248 |
1 |
N3O3C22H23 |
A3B3C22D23 |
-57.9 |
6.86 |
-9.13 |
-1.06 |
0 |
|
|
419468 |
135108249 |
1 |
O4N5C20H25 |
A4B5C20D25 |
-95.55 |
4.4 |
-9.23 |
-0.18 |
0 |
|
|
419469 |
135108250 |
1 |
SO2N4C18H18 |
AB2C4D18E18 |
21.65 |
4.7 |
-9.3 |
-1.1 |
0 |
|
|
419470 |
135108251 |
1 |
ClN2O4C18H25 |
AB2C4D18E25 |
-191.34 |
3.77 |
-8.8 |
-0.12 |
0 |
|
|
419471 |
135108253 |
1 |
NO6C17H19 |
AB6C17D19 |
-209.88 |
8.2 |
-9.13 |
-0.67 |
0 |
|
|
419472 |
135108254 |
1 |
N2O4C19H20 |
A2B4C19D20 |
-76.8 |
2.49 |
-9.3 |
-0.9 |
0 |
|
|
419474 |
135108257 |
1 |
ON4C14H24 |
AB4C14D24 |
-30.12 |
3.91 |
-8.4 |
0.39 |
0 |
|
|
419475 |
135108258 |
1 |
ClFNO5H11C14 |
ABCD5E11F14 |
-210.28 |
8.8 |
-10.26 |
-1.24 |
0 |
|
|
419476 |
135108259 |
1 |
SO6N8C33H42 |
AB6C8D33E42 |
-187.44 |
9.16 |
-9.28 |
-1.19 |
0 |
|
|
419477 |
135108260 |
1 |
N3O6C16H17 |
A3B6C16D17 |
-203.3 |
2.53 |
-9.55 |
-0.82 |
0 |
|
|
419478 |
135108261 |
1 |
FN3O4C18H22 |
AB3C4D18E22 |
-134.34 |
5.37 |
-9.18 |
-1.3 |
0 |
|
|
419479 |
135108262 |
2 |
ON3C8H12 |
AB3C8D12 |
5.34 |
4.61 |
-9.74 |
0.18 |
0 |
|
|
419480 |
135108263 |
1 |
N3O4C20H27 |
A3B4C20D27 |
-106.86 |
4.86 |
-8.53 |
-0.7 |
0 |
|
|
419481 |
135108264 |
1 |
O2N5C20H23 |
A2B5C20D23 |
7.96 |
11.3 |
-8.99 |
-0.34 |
0 |
|
|
419482 |
135108265 |
1 |
ON6C18H30 |
AB6C18D30 |
-26.62 |
3.51 |
-8.59 |
0.49 |
0 |
|
|
419483 |
135108266 |
1 |
FON5C13H20 |
ABC5D13E20 |
22.16 |
3.46 |
-8.48 |
0.15 |
0 |
|
|
419484 |
135108267 |
2 |
ON2C9H9 |
AB2C9D9 |
35.87 |
2.76 |
-9.41 |
-0.63 |
0 |
|
|
419485 |
135108268 |
1 |
ClN6O6C36H43 |
AB6C6D36E43 |
-222.99 |
7.81 |
-9.41 |
-1.02 |
0 |
|
|
419486 |
135108269 |
1 |
OSN4C17H20 |
ABC4D17E20 |
8.47 |
2.99 |
-8.96 |
-0.31 |
0 |
|
|
419487 |
135108270 |
1 |
SO4N5C15H25 |
AB4C5D15E25 |
-145.48 |
4.15 |
-9.35 |
-0.72 |
0 |
|
|
419488 |
135108271 |
1 |
O2N3C20H23 |
A2B3C20D23 |
-37.43 |
4.77 |
-9.23 |
-0.69 |
0 |
|
|
419489 |
135108272 |
2 |
N3C11H14 |
A3B11C14 |
76.67 |
3.82 |
-8.58 |
-0.04 |
0 |
|
|
419490 |
135108273 |
1 |
O5N7C37H51 |
A5B7C37D51 |
-171.13 |
5.15 |
-8.98 |
-0.15 |
0 |
|
|
419491 |
135108274 |
1 |
N3O5C18H21 |
A3B5C18D21 |
-130.82 |
4.38 |
-9.23 |
-1.08 |
0 |
|
|
419492 |
135108275 |
1 |
OSN6C14H18 |
ABC6D14E18 |
32.49 |
1.78 |
-8.93 |
-0.81 |
0 |
|
|
419493 |
135108276 |
1 |
FNO6H14C15 |
ABC6D14E15 |
-241.97 |
7.4 |
-9.78 |
-0.65 |
0 |
|
|
419494 |
135108277 |
1 |
N8C13H14 |
A8B13C14 |
122.13 |
4.38 |
-9.51 |
-0.95 |
0 |
|
|
419495 |
135108278 |
1 |
ClO2N3C19H26 |
AB2C3D19E26 |
-91.69 |
7.28 |
-9.3 |
-0.06 |
0 |
|
|
419496 |
135108279 |
1 |
N3O3C21H25 |
A3B3C21D25 |
-43.22 |
6.21 |
-8.41 |
-0.12 |
0 |
|
|
419497 |
135108280 |
2 |
ON3C9H12 |
AB3C9D12 |
-39.58 |
7.53 |
-8.99 |
-0.3 |
0 |
|
|
419498 |
135108281 |
1 |
N2O5C19H26 |
A2B5C19D26 |
-125.43 |
4.36 |
-8.36 |
0.02 |
0 |
|
|
419499 |
135108282 |
1 |
N5C18H21 |
A5B18C21 |
123.57 |
3.93 |
-9.12 |
-0.63 |
0 |
|
|
419500 |
135108288 |
1 |
N5O7C34H45 |
A5B7C34D45 |
-257.06 |
9.39 |
-8.12 |
-0.01 |
0 |
|
|
419501 |
135108291 |
1 |
SN2O5C18H24 |
AB2C5D18E24 |
-194.45 |
9.29 |
-9.37 |
-0.55 |
0 |
|
|
419502 |
135108296 |
1 |
N3O3C22H23 |
A3B3C22D23 |
-91.06 |
8.96 |
-9.12 |
-0.76 |
0 |
|
|
419503 |
135108302 |
1 |
O4N7C34H45 |
A4B7C34D45 |
-125.36 |
6.35 |
-9.36 |
-0.45 |
0 |
|
|
419504 |
135108320 |
1 |
FN5C17H22 |
AB5C17D22 |
24.86 |
2.64 |
-8.4 |
-0.27 |
0 |
|
|
419505 |
135108321 |
1 |
ON6C16H20 |
AB6C16D20 |
63.22 |
2.34 |
-8.61 |
-0.71 |
0 |
|
|
419506 |
135108323 |
1 |
O2N3C23H25 |
A2B3C23D25 |
-21.9 |
5.85 |
-8.57 |
-0.29 |
0 |
|
|
419507 |
135108327 |
1 |
FN2O3C20H27 |
AB2C3D20E27 |
-180.82 |
4.55 |
-9.39 |
0.04 |
0 |
|
|
419508 |
135108328 |
1 |
OSN4C19H24 |
ABC4D19E24 |
10.84 |
4.55 |
-8.57 |
-0.02 |
0 |
|
|
419509 |
135108329 |
1 |
SN7O7C39H51 |
AB7C7D39E51 |
-193.51 |
4.38 |
-8.78 |
-1.6 |
0 |
|
|
419510 |
135108330 |
1 |
FN2O3C19H21 |
AB2C3D19E21 |
-151.9 |
6.0 |
-9.14 |
-0.96 |
0 |
|
|
419511 |
135108331 |
1 |
FN2O4C17H19 |
AB2C4D17E19 |
-135.72 |
3.06 |
-9.65 |
-0.65 |
0 |
|
|
419512 |
135108332 |
1 |
O2N3C19H29 |
A2B3C19D29 |
-68.32 |
3.06 |
-8.6 |
0.42 |
0 |
|
|
419513 |
135108333 |
1 |
ON3C17H29 |
AB3C17D29 |
-21.96 |
4.95 |
-9.02 |
0.78 |
0 |
|
|
419514 |
135108334 |
1 |
ON5C22H27 |
AB5C22D27 |
14.5 |
3.97 |
-8.76 |
-0.58 |
0 |
|
|
419515 |
135108335 |
1 |
N6O7C36H48 |
A6B7C36D48 |
-277.28 |
11.02 |
-9.18 |
0.07 |
0 |
|
|
419516 |
135108336 |
1 |
SN3O4C17H23 |
AB3C4D17E23 |
-126.86 |
5.06 |
-8.78 |
-0.67 |
0 |
|
|
419517 |
135108337 |
1 |
N2O4C21H24 |
A2B4C21D24 |
-110.88 |
5.3 |
-8.67 |
-0.84 |
0 |
|
|
419518 |
135108338 |
1 |
O2N3C18H23 |
A2B3C18D23 |
-48.51 |
6.65 |
-8.56 |
-0.29 |
0 |
|
|
419519 |
135108339 |
1 |
ON4C18H24 |
AB4C18D24 |
9.26 |
4.09 |
-8.94 |
0.01 |
0 |
|
|
419520 |
135108340 |
1 |
SN6O6C31H42 |
AB6C6D31E42 |
-231.19 |
10.07 |
-8.43 |
-0.76 |
0 |
|
|
419521 |
135108341 |
1 |
FN4O4C18H23 |
AB4C4D18E23 |
-144.75 |
1.83 |
-9.2 |
-1.19 |
0 |
|
|
419522 |
135108342 |
1 |
N3O4C20H23 |
A3B4C20D23 |
-75.94 |
3.93 |
-9.53 |
-1.22 |
0 |
|
|
419523 |
135108343 |
1 |
ON4C20H30 |
AB4C20D30 |
-24.46 |
4.58 |
-8.67 |
0.38 |
0 |
|
|
419524 |
135108344 |
1 |
N3O3C19H23 |
A3B3C19D23 |
-75.84 |
1.31 |
-8.88 |
0.11 |
0 |
|
|
419525 |
135108345 |
1 |
O2N5C19H21 |
A2B5C19D21 |
2.63 |
3.22 |
-9.36 |
-1.22 |
0 |
|
|
419526 |
135108346 |
1 |
ON8C14H18 |
AB8C14D18 |
66.44 |
4.67 |
-9.12 |
-0.74 |
0 |
|
|
419527 |
135108347 |
1 |
SO2N3C17H27 |
AB2C3D17E27 |
-75.02 |
4.74 |
-9.05 |
-0.77 |
0 |
|
|
419528 |
135108348 |
1 |
SN3O3C19H19 |
AB3C3D19E19 |
-14.83 |
7.04 |
-9.24 |
-0.56 |
0 |
|
|
419529 |
135108349 |
1 |
N2O2C17H24 |
A2B2C17D24 |
-43.1 |
4.43 |
-9.38 |
0.83 |
0 |
|
|
419530 |
135108350 |
3 |
NOC7H9 |
ABC7D9 |
-110.83 |
3.95 |
-8.5 |
-0.04 |
0 |
|
|
419531 |
135108351 |
1 |
N4O5H14C15 |
A4B5C14D15 |
-93.27 |
7.93 |
-9.75 |
-1.23 |
0 |
|
|
419532 |
135108352 |
1 |
SO3N4C21H26 |
AB3C4D21E26 |
-82.82 |
3.73 |
-8.99 |
-0.24 |
0 |
|
|
419533 |
135108381 |
1 |
ON5C16H27 |
AB5C16D27 |
-20.88 |
3.09 |
-8.37 |
0.2 |
0 |
|
|
419534 |
135108385 |
1 |
N3O4C19H23 |
A3B4C19D23 |
-83.1 |
4.32 |
-8.41 |
-1.12 |
0 |
|
|
419535 |
135108391 |
1 |
N2O2C19H24 |
A2B2C19D24 |
-64.62 |
3.16 |
-8.7 |
-0.48 |
0 |
|
|
419536 |
135108392 |
1 |
SO2N4C19H20 |
AB2C4D19E20 |
-1.7 |
6.44 |
-8.97 |
-0.75 |
0 |
|
|
419537 |
135108393 |
1 |
OSN3C13H19 |
ABC3D13E19 |
2.77 |
3.74 |
-8.66 |
-0.51 |
0 |
|
|
419538 |
135108394 |
1 |
SN2O3C18H28 |
AB2C3D18E28 |
-125.78 |
7.13 |
-8.98 |
-0.58 |
0 |
|
|
419539 |
135108395 |
1 |
ClN2O2C18H21 |
AB2C2D18E21 |
-45.29 |
6.35 |
-8.8 |
-0.37 |
0 |
|
|
419540 |
135108396 |
1 |
O2N5C15H23 |
A2B5C15D23 |
-8.62 |
6.28 |
-9.54 |
0.03 |
0 |
|
|
419541 |
135108397 |
1 |
N3O3C21H25 |
A3B3C21D25 |
-87.67 |
4.95 |
-9.55 |
-0.9 |
0 |
|
|
419542 |
135108398 |
2 |
ON2C11H14 |
AB2C11D14 |
-45.88 |
4.88 |
-8.54 |
0.01 |
0 |
|
|
419543 |
135108399 |
1 |
O2N3C18H31 |
A2B3C18D31 |
-99.23 |
6.49 |
-9.4 |
0.46 |
0 |
|
|
419544 |
135108400 |
1 |
NSF2O5C16H19 |
ABC2D5E16F19 |
-267.95 |
7.88 |
-10.0 |
-1.48 |
0 |