List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
18273 |
539335 |
1 |
O4C11H14 |
A4B11C14 |
-150.54 |
3.71 |
-10.23 |
0.48 |
0 |
|
|
18274 |
539336 |
1 |
OSeC8H16 |
ABC8D16 |
-54.85 |
4.15 |
-8.27 |
-0.7 |
0 |
|
|
18275 |
539340 |
1 |
O2C13H22 |
A2B13C22 |
-118.23 |
1.95 |
-10.07 |
-0.03 |
0 |
|
|
18276 |
539345 |
2 |
OC5H8 |
AB5C8 |
-102.01 |
4.73 |
-9.81 |
-0.08 |
0 |
|
|
18277 |
539348 |
1 |
NO3C29H47 |
AB3C29D47 |
-202.21 |
2.25 |
-9.31 |
0.77 |
0 |
|
|
18278 |
539349 |
1 |
NO4C30H45 |
AB4C30D45 |
-230.29 |
4.35 |
-8.71 |
0.62 |
0 |
|
|
18279 |
539350 |
2 |
OC6H9 |
AB6C9 |
-93.29 |
3.1 |
-9.85 |
0.6 |
0 |
|
|
18280 |
539352 |
1 |
FO2N4H13C17 |
AB2C4D13E17 |
14.34 |
5.41 |
-10.13 |
-0.74 |
0 |
|
|
18281 |
539353 |
1 |
N2O4C23H28 |
A2B4C23D28 |
-119.27 |
4.99 |
-8.85 |
-0.05 |
0 |
|
|
18282 |
539354 |
1 |
ClO2N5C12H12 |
AB2C5D12E12 |
-10.72 |
5.86 |
-9.1 |
-0.83 |
0 |
|
|
18283 |
539355 |
1 |
O6C13H20 |
A6B13C20 |
-277.33 |
2.33 |
-10.43 |
-0.18 |
0 |
|
|
18284 |
539357 |
1 |
O3C12H20 |
A3B12C20 |
-153.35 |
4.26 |
-10.04 |
0.92 |
0 |
|
|
18285 |
539358 |
1 |
O3C13H22 |
A3B13C22 |
-133.01 |
0.99 |
-9.96 |
0.7 |
0 |
|
|
18286 |
539363 |
1 |
NSO2C8H11 |
ABC2D8E11 |
-74.11 |
1.01 |
-9.39 |
-0.44 |
0 |
|
|
18287 |
539364 |
1 |
O5C16H22 |
A5B16C22 |
-210.76 |
3.58 |
-10.0 |
-0.64 |
0 |
|
|
18288 |
539367 |
1 |
ClO2N3H20C21 |
AB2C3D20E21 |
-23.16 |
1.79 |
-9.12 |
-0.52 |
0 |
|
|
18289 |
539370 |
1 |
BO3C10H19 |
AB3C10D19 |
-224.38 |
5.14 |
-10.12 |
0.6 |
0 |
|
|
18290 |
539371 |
1 |
NOC14H23 |
ABC14D23 |
-65.28 |
1.86 |
-9.49 |
0.57 |
0 |
|
|
18291 |
539403 |
1 |
N3O3C6H7 |
A3B3C6D7 |
-18.83 |
3.64 |
-10.42 |
-1.68 |
0 |
|
|
18292 |
539422 |
1 |
O14C25H30 |
A14B25C30 |
-600.97 |
3.61 |
-8.89 |
-0.14 |
0 |
|
|
18293 |
539423 |
1 |
NOSC8H11 |
ABCD8E11 |
-25.23 |
5.6 |
-8.52 |
-0.62 |
0 |
|
|
18294 |
539477 |
1 |
ClON3C6H6 |
ABC3D6E6 |
-15.05 |
0.53 |
-10.29 |
-1.09 |
0 |
|
|
18295 |
539479 |
2 |
OC8H16 |
AB8C16 |
-165.63 |
2.0 |
-10.79 |
0.95 |
0 |
|
|
18296 |
539480 |
1 |
S3O6C10H14 |
A3B6C10D14 |
-231.34 |
1.71 |
-10.04 |
-1.83 |
0 |
|
|
18297 |
539482 |
1 |
NS2O3C8H15 |
AB2C3D8E15 |
-151.93 |
4.37 |
-9.26 |
-1.4 |
0 |
|
|
18298 |
539483 |
1 |
N2O5C21H22 |
A2B5C21D22 |
-152.61 |
1.94 |
-8.61 |
-0.23 |
0 |
|
|
18299 |
539488 |
1 |
SN2O3C11H14 |
AB2C3D11E14 |
-118.22 |
6.96 |
-8.86 |
-0.44 |
0 |
|
|
18300 |
539492 |
1 |
O4C13H14 |
A4B13C14 |
-148.06 |
3.33 |
-9.49 |
-0.31 |
0 |
|
|
18301 |
539493 |
1 |
ClNOC5H6 |
ABCD5E6 |
-3.13 |
2.18 |
-9.65 |
-0.07 |
0 |
|
|
18302 |
539497 |
2 |
O4C5H8 |
A4B5C8 |
-356.53 |
2.85 |
-10.28 |
0.16 |
0 |
|
|
18303 |
539499 |
1 |
O5C8H14 |
A5B8C14 |
-241.14 |
1.06 |
-10.58 |
0.53 |
0 |
|
|
18304 |
539502 |
1 |
NO4H11C14 |
AB4C11D14 |
-97.17 |
4.8 |
-9.63 |
-1.42 |
0 |
|
|
18305 |
539511 |
1 |
O3C19H32 |
A3B19C32 |
-115.67 |
2.69 |
-9.18 |
0.75 |
0 |
|
|
18306 |
539516 |
1 |
O4C23H32 |
A4B23C32 |
-204.5 |
3.64 |
-9.8 |
-0.31 |
0 |
|
|
18307 |
539521 |
1 |
OC14H22 |
AB14C22 |
-54.85 |
1.84 |
-9.63 |
1.2 |
0 |
|
|
18308 |
539583 |
1 |
O3C12H22 |
A3B12C22 |
-179.06 |
3.13 |
-10.49 |
0.86 |
0 |
|
|
18309 |
539584 |
4 |
OC3H5 |
AB3C5 |
-213.43 |
2.66 |
-10.76 |
0.68 |
0 |
|
|
18310 |
539590 |
1 |
N2O2C11H14 |
A2B2C11D14 |
-82.49 |
2.92 |
-9.0 |
-0.55 |
0 |
|
|
18311 |
539594 |
1 |
SO4C13H14 |
AB4C13D14 |
-153.07 |
3.69 |
-9.08 |
-1.0 |
0 |
|
|
18312 |
539595 |
2 |
O2C7H12 |
A2B7C12 |
-224.09 |
3.08 |
-10.61 |
0.83 |
0 |
|
|
18313 |
539598 |
1 |
INO2C13H18 |
ABC2D13E18 |
-75.46 |
1.39 |
-9.11 |
-1.07 |
0 |
|
|
18314 |
539599 |
1 |
O7C19H28 |
A7B19C28 |
-301.6 |
3.81 |
-10.09 |
-0.08 |
0 |
|
|
18315 |
539602 |
2 |
OC7H11 |
AB7C11 |
-89.29 |
6.67 |
-9.36 |
0.22 |
0 |
|
|
18316 |
539616 |
2 |
NO3C10H17 |
AB3C10D17 |
-298.66 |
1.38 |
-9.33 |
0.22 |
0 |
|
|
18317 |
539617 |
1 |
NO10C24H31 |
AB10C24D31 |
-275.9 |
3.68 |
-9.46 |
-1.52 |
0 |
|
|
18318 |
539618 |
2 |
O2C5H7 |
A2B5C7 |
-155.2 |
1.85 |
-9.96 |
0.65 |
0 |
|
|
18319 |
539619 |
2 |
O2C5H7 |
A2B5C7 |
-189.9 |
3.44 |
-10.29 |
0.4 |
0 |
|
|
18320 |
539620 |
1 |
O4C11H16 |
A4B11C16 |
-157.64 |
3.61 |
-9.9 |
0.47 |
0 |
|
|
18321 |
539621 |
1 |
O3N8C16H22 |
A3B8C16D22 |
-10.24 |
5.09 |
-9.51 |
-1.07 |
0 |
|
|
18322 |
539638 |
1 |
SO10C19H24 |
AB10C19D24 |
-425.04 |
2.92 |
-10.06 |
-0.59 |
0 |
|
|
18323 |
539645 |
1 |
O2C11H18 |
A2B11C18 |
-100.28 |
5.21 |
-9.4 |
0.49 |
0 |
|
|
18324 |
539646 |
1 |
ClO4C11H11 |
AB4C11D11 |
-170.49 |
3.48 |
-9.73 |
-0.54 |
0 |
|
|
18325 |
539647 |
1 |
SN2O3H12C14 |
AB2C3D12E14 |
-48.64 |
6.07 |
-8.79 |
-0.87 |
0 |
|
|
18326 |
539650 |
1 |
O2C13H22 |
A2B13C22 |
-118.36 |
4.0 |
-8.59 |
1.39 |
0 |
|
|
18327 |
539652 |
2 |
O2C13H20 |
A2B13C20 |
-149.74 |
1.28 |
-10.04 |
0.39 |
0 |
|
|
18328 |
539653 |
1 |
O13C23H34 |
A13B23C34 |
-606.48 |
1.22 |
-10.11 |
0.48 |
0 |
|
|
18329 |
539657 |
1 |
O17C33H48 |
A17B33C48 |
-758.69 |
6.33 |
-9.45 |
0.31 |
0 |
|
|
18330 |
539658 |
2 |
O2C14H19 |
A2B14C19 |
-222.94 |
0.91 |
-8.88 |
0.52 |
0 |
|
|
18331 |
539659 |
1 |
O5C29H42 |
A5B29C42 |
-219.65 |
6.07 |
-8.78 |
-0.26 |
0 |
|
|
18332 |
539660 |
1 |
NO2C27H45 |
AB2C27D45 |
-157.16 |
1.36 |
-9.23 |
2.07 |
0 |
|
|
18333 |
539661 |
1 |
SO3C11H16 |
AB3C11D16 |
-126.05 |
6.88 |
-9.79 |
-0.6 |
0 |
|
|
18334 |
539662 |
1 |
OSN4C6H6 |
ABC4D6E6 |
31.93 |
2.27 |
-9.97 |
-1.46 |
0 |
|
|
18335 |
539663 |
1 |
ClNPSO2C8H19 |
ABCDE2F8G19 |
-208.07 |
2.27 |
-9.32 |
0.35 |
0 |
|
|
18336 |
539716 |
1 |
O10C17H26 |
A10B17C26 |
-470.21 |
1.4 |
-10.33 |
0.54 |
0 |
|
|
18337 |
539717 |
1 |
NSO4C14H15 |
ABC4D14E15 |
-137.3 |
8.52 |
-9.0 |
-1.26 |
0 |
|
|
18338 |
539720 |
2 |
ON2H6C9 |
AB2C6D9 |
68.64 |
5.5 |
-9.61 |
-1.89 |
0 |
|
|
18339 |
539721 |
1 |
NO12C20H31 |
AB12C20D31 |
-544.24 |
3.78 |
-9.87 |
-0.04 |
0 |
|
|
18340 |
539725 |
1 |
BrNO6H14C15 |
ABC6D14E15 |
-194.97 |
2.27 |
-9.26 |
-1.65 |
0 |
|
|
18341 |
539726 |
1 |
S2N3C10H17 |
A2B3C10D17 |
29.37 |
3.51 |
-8.55 |
-0.54 |
0 |
|
|
18342 |
539727 |
1 |
FSO5C9H11 |
ABC5D9E11 |
-242.69 |
2.17 |
-9.77 |
-1.26 |
0 |
|
|
18343 |
539728 |
1 |
NSO4C8H15 |
ABC4D8E15 |
-186.21 |
3.83 |
-9.19 |
0.12 |
0 |
|
|
18344 |
539739 |
1 |
N2O2H16C19 |
A2B2C16D19 |
23.18 |
4.37 |
-8.76 |
-0.39 |
0 |
|
|
18345 |
539770 |
1 |
BrO3C7H7 |
AB3C7D7 |
-103.7 |
7.36 |
-9.29 |
-0.66 |
0 |
|
|
18346 |
539775 |
1 |
O4C23H32 |
A4B23C32 |
-146.91 |
4.77 |
-9.69 |
-0.01 |
0 |
|
|
18347 |
539776 |
2 |
OSiC12H26 |
ABC12D26 |
-268.54 |
3.57 |
-9.3 |
0.79 |
0 |