List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
335398 |
127254260 |
1 |
ClNO5C31H34 |
ABC5D31E34 |
-196.29 |
5.41 |
-9.16 |
-0.77 |
0 |
|
|
335399 |
127254261 |
1 |
ClNO5C30H34 |
ABC5D30E34 |
-204.2 |
9.01 |
-8.99 |
-0.52 |
0 |
|
|
335400 |
127254262 |
1 |
ClNO5C30H32 |
ABC5D30E32 |
-191.85 |
5.27 |
-9.14 |
-0.91 |
0 |
|
|
335401 |
127254263 |
2 |
NO2C13H16 |
AB2C13D16 |
-148.97 |
2.77 |
-8.57 |
-0.15 |
0 |
|
|
335402 |
127254264 |
1 |
N2O4C27H36 |
A2B4C27D36 |
-159.02 |
2.92 |
-8.35 |
0.15 |
0 |
|
|
335403 |
127254265 |
1 |
NO5C35H37 |
AB5C35D37 |
-161.25 |
9.78 |
-8.96 |
-0.49 |
0 |
|
|
335404 |
127254266 |
1 |
ClNO5C30H32 |
ABC5D30E32 |
-179.95 |
12.34 |
-8.7 |
-0.61 |
0 |
|
|
335405 |
127254267 |
1 |
ClNO5C30H32 |
ABC5D30E32 |
-193.95 |
8.54 |
-9.1 |
-0.7 |
0 |
|
|
335407 |
127254269 |
1 |
ClNO5C31H32 |
ABC5D31E32 |
-183.37 |
5.47 |
-8.79 |
-0.92 |
0 |
|
|
335409 |
127254271 |
1 |
NO5C20H29 |
AB5C20D29 |
-218.87 |
3.61 |
-8.0 |
0.23 |
0 |
|
|
335410 |
127254272 |
1 |
ClNO5C30H34 |
ABC5D30E34 |
-204.34 |
3.85 |
-9.41 |
-0.86 |
0 |
|
|
335411 |
127254273 |
1 |
NO5C29H33 |
AB5C29D33 |
-178.06 |
9.97 |
-9.11 |
-0.79 |
0 |
|
|
335413 |
127254275 |
1 |
ClNO5C31H36 |
ABC5D31E36 |
-200.45 |
10.52 |
-9.18 |
-0.86 |
0 |
|
|
335419 |
127254281 |
1 |
NO7C29H37 |
AB7C29D37 |
-238.21 |
1.93 |
-8.59 |
-0.36 |
0 |
|
|
335420 |
127254282 |
1 |
NO3C25H29 |
AB3C25D29 |
-86.92 |
1.45 |
-8.75 |
-0.38 |
0 |
|
|
335421 |
127254283 |
1 |
ClNF3O5H25C27 |
ABC3D5E25F27 |
-328.73 |
5.4 |
-9.51 |
-1.75 |
0 |
|
|
335422 |
127254284 |
1 |
ClNO5C32H36 |
ABC5D32E36 |
-196.71 |
4.96 |
-8.8 |
-0.6 |
0 |
|
|
335424 |
127254286 |
1 |
N3O5H19C20 |
A3B5C19D20 |
-34.63 |
5.43 |
-9.33 |
-1.35 |
0 |
|
|
335425 |
127254287 |
1 |
N3O3C20H21 |
A3B3C20D21 |
-29.12 |
7.8 |
-8.24 |
-0.31 |
0 |
|
|
335426 |
127254288 |
1 |
ClPN3O4H11C12 |
ABC3D4E11F12 |
-168.17 |
5.48 |
-9.24 |
-1.34 |
0 |
|
|
335427 |
127254289 |
1 |
Cl2N3C14H15 |
A2B3C14D15 |
1.01 |
5.04 |
-9.43 |
-0.6 |
0 |
|
|
335428 |
127254290 |
1 |
ClON4H11C12 |
ABC4D11E12 |
35.97 |
7.4 |
-9.4 |
-0.68 |
0 |
|
|
335429 |
127254291 |
1 |
BrClOC5N5H13 |
ABCD5E5F13 |
-55.75 |
8.58 |
-9.09 |
-0.35 |
0 |
|
|
335430 |
127254292 |
1 |
KSO2N3C10H14 |
ABC2D3E10F14 |
-101.58 |
13.26 |
-8.43 |
-0.18 |
0 |
|
|
335431 |
127254293 |
1 |
N2O5C14H16 |
A2B5C14D16 |
-166.4 |
13.44 |
-9.31 |
-1.44 |
0 |
|
|
335432 |
127254294 |
1 |
ClON2C10H17 |
ABC2D10E17 |
-49.32 |
2.15 |
-8.1 |
0.39 |
0 |
|
|
335433 |
127254295 |
1 |
ClNOC13H16 |
ABCD13E16 |
-31.74 |
5.42 |
-9.07 |
0.2 |
0 |
|
|
335434 |
127254296 |
1 |
ClFNOC13H15 |
ABCDE13F15 |
-73.03 |
1.46 |
-9.42 |
-0.22 |
0 |
|
|
335435 |
127254297 |
1 |
ClNOC14H18 |
ABCD14E18 |
-32.35 |
2.06 |
-9.32 |
0.09 |
0 |
|
|
335436 |
127254298 |
1 |
ClNO2C19H26 |
ABC2D19E26 |
-93.69 |
3.94 |
-8.73 |
0.17 |
0 |
|
|
335437 |
127254299 |
1 |
NOCl2C8H11 |
ABC2D8E11 |
-65.8 |
1.57 |
-9.22 |
-0.36 |
0 |
|
|
335438 |
127254300 |
1 |
N2O4C13H16 |
A2B4C13D16 |
-117.64 |
1.4 |
-8.13 |
-1.56 |
0 |
|
|
335439 |
127254301 |
1 |
ClON3C8H10 |
ABC3D8E10 |
-9.09 |
1.76 |
-9.85 |
-1.07 |
0 |
|
|
335440 |
127254302 |
1 |
N3O3C5H7 |
A3B3C5D7 |
-62.72 |
7.75 |
-10.08 |
-0.66 |
0 |
|
|
335441 |
127254303 |
1 |
ClN3C14H18 |
AB3C14D18 |
36.89 |
3.78 |
-8.59 |
-0.23 |
0 |
|
|
335442 |
127254304 |
1 |
BrNaO2C4H4N4 |
ABC2D4E4F4 |
-79.76 |
11.04 |
-8.71 |
-0.1 |
0 |
|
|
335443 |
127254305 |
1 |
BrO2C4N4H5 |
AB2C4D4E5 |
-34.1 |
2.2 |
-9.92 |
-0.91 |
0 |
|
|
335444 |
127254306 |
1 |
ClN4O4H7C9 |
AB4C4D7E9 |
-69.46 |
4.16 |
-10.1 |
-1.53 |
0 |
|
|
335445 |
127254307 |
1 |
ClN4H5C7 |
AB4C5D7 |
91.53 |
1.83 |
-9.96 |
-1.33 |
0 |
|
|
335446 |
127254308 |
1 |
BrClN4C5H10 |
ABC4D5E10 |
8.12 |
4.23 |
-9.58 |
-0.5 |
0 |
|
|
335447 |
127254309 |
1 |
N2O4C17H24 |
A2B4C17D24 |
-149.76 |
1.82 |
-8.38 |
-1.24 |
0 |
|
|
335448 |
127254310 |
1 |
N2O4C19H20 |
A2B4C19D20 |
-101.27 |
3.7 |
-8.44 |
-1.26 |
0 |
|
|
335449 |
127254311 |
1 |
ClKN3O3C5H5 |
ABC3D3E5F5 |
-114.54 |
12.98 |
-9.2 |
-0.12 |
0 |
|
|
335450 |
127254312 |
1 |
ClN3O3C5H6 |
AB3C3D5E6 |
-71.8 |
3.38 |
-10.42 |
-1.29 |
0 |
|
|
335451 |
127254313 |
1 |
N3O4C11H13 |
A3B4C11D13 |
-127.16 |
9.51 |
-9.48 |
-0.92 |
0 |
|
|
335452 |
127254314 |
1 |
BrClC3N4H6 |
ABC3D4E6 |
9.51 |
3.54 |
-9.82 |
-0.6 |
0 |
|
|
335453 |
127254315 |
1 |
BSN2F4O4C15H21 |
ABC2D4E4F15G21 |
-498.1 |
9.8 |
-10.04 |
-1.44 |
0 |
|
|
335454 |
127254316 |
1 |
ClN2O4C15H19 |
AB2C4D15E19 |
-133.36 |
13.04 |
-8.11 |
-1.56 |
1 |
|
|
335455 |
127254317 |
1 |
N2O4C15H19 |
A2B4C15D19 |
-100.21 |
9.77 |
0.0 |
0.0 |
0 |
|
|
335456 |
127254318 |
1 |
N4O4H16C19 |
A4B4C16D19 |
-107.31 |
5.27 |
-9.05 |
-0.98 |
0 |
|
|
335457 |
127254319 |
1 |
F3O3N5H12C13 |
A3B3C5D12E13 |
-178.82 |
9.83 |
-9.09 |
-1.18 |
0 |
|
|
335458 |
127254320 |
1 |
NOSBr2C16H19 |
ABCD2E16F19 |
-26.8 |
2.39 |
-9.08 |
-1.01 |
0 |
|
|
335459 |
127254321 |
1 |
ClO3N4H15C22 |
AB3C4D15E22 |
-30.56 |
4.16 |
-9.2 |
-1.32 |
0 |
|
|
335460 |
127254322 |
1 |
N4O5H14C16 |
A4B5C14D16 |
-60.66 |
8.16 |
-9.46 |
-1.15 |
0 |
|
|
335462 |
127254324 |
2 |
OSN2C9H9 |
ABC2D9E9 |
16.12 |
5.98 |
-8.64 |
-1.63 |
0 |
|
|
335463 |
127254325 |
2 |
N2O2C11H11 |
A2B2C11D11 |
-99.99 |
3.65 |
-8.6 |
-0.87 |
0 |
|
|
335464 |
127254326 |
1 |
O3N6H26C28 |
A3B6C26D28 |
-6.04 |
4.43 |
-8.38 |
-1.08 |
0 |
|
|
335465 |
127254327 |
1 |
OSN3C18H19 |
ABC3D18E19 |
25.66 |
1.37 |
-8.53 |
-0.99 |
0 |
|
|
335466 |
127254328 |
1 |
BrOSN3H30C31 |
ABCD3E30F31 |
68.22 |
15.81 |
-7.61 |
-2.42 |
1 |
|
|
335467 |
127254329 |
1 |
BrOSN3C31H31 |
ABCD3E31F31 |
45.21 |
5.25 |
0.0 |
0.0 |
0 |
|
|
335468 |
127254330 |
2 |
ClNOC19H20 |
ABCD19E20 |
9.85 |
5.17 |
-9.31 |
0.06 |
0 |
|
|
335469 |
127254331 |
2 |
ClNO2H12C17 |
ABC2D12E17 |
-53.2 |
2.98 |
-8.67 |
-0.7 |
0 |
|
|
335470 |
127254332 |
1 |
O4N5H19C22 |
A4B5C19D22 |
-45.51 |
2.24 |
-9.33 |
-1.13 |
0 |
|
|
335471 |
127254333 |
1 |
SN2O6C22H24 |
AB2C6D22E24 |
-171.47 |
9.23 |
-8.69 |
-0.91 |
0 |
|
|
335472 |
127254334 |
1 |
ON4C19H24 |
AB4C19D24 |
1.65 |
2.29 |
-8.83 |
-0.22 |
0 |
|
|
335473 |
127254335 |
1 |
SN3O4H23C26 |
AB3C4D23E26 |
-17.34 |
1.78 |
-8.68 |
-1.82 |
0 |
|
|
335474 |
127254336 |
1 |
N2O2C19H30 |
A2B2C19D30 |
-107.25 |
7.33 |
-8.68 |
1.05 |
0 |
|
|
335475 |
127254337 |
1 |
OSF3N5H10C14 |
ABC3D5E10F14 |
-54.85 |
9.8 |
-9.49 |
-1.86 |
0 |
|
|
335476 |
127254338 |
1 |
ClN6O9C26H37 |
AB6C9D26E37 |
-342.72 |
3.12 |
-8.41 |
-0.83 |
0 |
|
|
335477 |
127254339 |
1 |
ON2C21H24 |
AB2C21D24 |
35.82 |
4.16 |
-9.24 |
0.18 |
0 |
|
|
335478 |
127254340 |
1 |
SO3N5H21C24 |
AB3C5D21E24 |
-16.81 |
7.6 |
-8.39 |
-1.17 |
0 |
|
|
335479 |
127254341 |
1 |
ClSN2O3C15H19 |
ABC2D3E15F19 |
-102.6 |
7.34 |
-9.1 |
-0.47 |
0 |
|
|
335480 |
127254342 |
1 |
N4O7C26H26 |
A4B7C26D26 |
-229.8 |
8.01 |
-8.53 |
-0.79 |
0 |
|
|
335481 |
127254343 |
1 |
N2O3H18C22 |
A2B3C18D22 |
14.09 |
3.29 |
-8.46 |
-0.68 |
0 |
|
|
335482 |
127254344 |
1 |
O2N4C23H32 |
A2B4C23D32 |
-49.62 |
3.82 |
-8.78 |
-0.12 |
0 |