List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
364189 |
127314487 |
1 |
N2S2O4C15H20 |
A2B2C4D15E20 |
-156.54 |
1.67 |
-8.27 |
-0.15 |
0 |
|
|
364190 |
127314488 |
1 |
OSN3C16H25 |
ABC3D16E25 |
-36.74 |
5.93 |
-8.44 |
0.64 |
0 |
|
|
364191 |
127314494 |
1 |
SN2O2C19H28 |
AB2C2D19E28 |
-89.78 |
4.51 |
-8.37 |
0.02 |
0 |
|
|
364192 |
127314495 |
1 |
O2N5C19H25 |
A2B5C19D25 |
-30.82 |
6.16 |
-9.64 |
-0.27 |
0 |
|
|
364193 |
127314496 |
1 |
OSN6C13H14 |
ABC6D13E14 |
56.59 |
9.12 |
-9.33 |
-1.03 |
0 |
|
|
364194 |
127314497 |
1 |
ON6C11H14 |
AB6C11D14 |
25.08 |
4.56 |
-9.87 |
-0.57 |
0 |
|
|
364195 |
127314498 |
2 |
ON3C8H8 |
AB3C8D8 |
26.4 |
11.26 |
-9.5 |
-1.32 |
0 |
|
|
364196 |
127314499 |
1 |
O2N5C18H21 |
A2B5C18D21 |
-27.39 |
5.66 |
-9.49 |
-0.29 |
0 |
|
|
364197 |
127314500 |
1 |
ON6C10H12 |
AB6C10D12 |
36.02 |
3.79 |
-9.95 |
-0.76 |
0 |
|
|
364198 |
127314501 |
1 |
O3N5C18H21 |
A3B5C18D21 |
-66.58 |
10.79 |
-9.67 |
-0.72 |
0 |
|
|
364199 |
127314502 |
1 |
O2N5C20H29 |
A2B5C20D29 |
-83.99 |
6.97 |
-9.77 |
0.35 |
0 |
|
|
364200 |
127314503 |
1 |
O2N3C21H23 |
A2B3C21D23 |
-30.78 |
8.16 |
-8.53 |
-0.84 |
0 |
|
|
364201 |
127314504 |
1 |
OSN5C20H25 |
ABC5D20E25 |
18.38 |
5.96 |
-8.63 |
-0.6 |
0 |
|
|
364202 |
127314505 |
1 |
O2N6C19H24 |
A2B6C19D24 |
-9.43 |
8.56 |
-8.72 |
-0.77 |
0 |
|
|
364203 |
127314506 |
1 |
ON4C16H26 |
AB4C16D26 |
-34.16 |
7.83 |
-8.44 |
1.06 |
0 |
|
|
364204 |
127314507 |
1 |
SO3N4C17H28 |
AB3C4D17E28 |
-116.73 |
8.63 |
-8.86 |
0.68 |
0 |
|
|
364205 |
127314508 |
1 |
O2N3C21H27 |
A2B3C21D27 |
-70.87 |
7.86 |
-8.64 |
-0.33 |
0 |
|
|
364206 |
127314509 |
1 |
O2N5C20H23 |
A2B5C20D23 |
-0.53 |
11.19 |
-8.59 |
-0.91 |
0 |
|
|
364207 |
127314510 |
3 |
NOC7H9 |
ABC7D9 |
-100.44 |
9.73 |
-8.41 |
-0.36 |
0 |
|
|
364208 |
127314511 |
2 |
ON2C11H14 |
AB2C11D14 |
-60.4 |
5.42 |
-8.51 |
-0.24 |
0 |
|
|
364209 |
127314512 |
1 |
O2N5C20H23 |
A2B5C20D23 |
-29.29 |
6.69 |
-8.74 |
-0.71 |
0 |
|
|
364210 |
127314513 |
1 |
ON6C20H28 |
AB6C20D28 |
10.19 |
8.87 |
-8.43 |
-0.08 |
0 |
|
|
364211 |
127314514 |
1 |
O3N4C22H28 |
A3B4C22D28 |
-92.13 |
3.37 |
-8.64 |
-0.12 |
0 |
|
|
364212 |
127314515 |
1 |
O2N3C16H25 |
A2B3C16D25 |
-89.67 |
6.25 |
-8.59 |
0.87 |
0 |
|
|
364213 |
127314516 |
2 |
NOC10H15 |
ABC10D15 |
-93.9 |
3.43 |
-8.6 |
0.16 |
0 |
|
|
364214 |
127314517 |
2 |
ON3C8H12 |
AB3C8D12 |
-41.65 |
4.59 |
-8.72 |
-0.96 |
0 |
|
|
364215 |
127314519 |
1 |
SO2N5C18H25 |
AB2C5D18E25 |
-29.9 |
6.82 |
-8.52 |
-0.95 |
0 |
|
|
364216 |
127314520 |
1 |
O3N4C18H26 |
A3B4C18D26 |
-108.29 |
8.78 |
-8.57 |
-1.01 |
0 |
|
|
364217 |
127314521 |
1 |
O2N4C23H34 |
A2B4C23D34 |
-69.33 |
6.59 |
-8.67 |
0.16 |
0 |
|
|
364218 |
127314522 |
1 |
O2N5C16H25 |
A2B5C16D25 |
-61.3 |
3.76 |
-8.81 |
-0.3 |
0 |
|
|
364219 |
127314523 |
2 |
ON2C10H18 |
AB2C10D18 |
-108.98 |
6.74 |
-8.59 |
1.15 |
0 |
|
|
364220 |
127314524 |
1 |
N3O3C22H31 |
A3B3C22D31 |
-124.83 |
8.62 |
-8.47 |
-0.4 |
0 |
|
|
364221 |
127314525 |
1 |
O3N5C21H27 |
A3B5C21D27 |
-58.63 |
9.18 |
-8.54 |
-1.14 |
0 |
|
|
364222 |
127314526 |
1 |
O2N5C15H23 |
A2B5C15D23 |
-50.01 |
3.99 |
-8.81 |
-0.47 |
0 |
|
|
364223 |
127314527 |
1 |
O3N5C21H27 |
A3B5C21D27 |
-89.98 |
8.38 |
-8.67 |
-1.12 |
0 |
|
|
364224 |
127314528 |
2 |
ON2C9H13 |
AB2C9D13 |
-56.5 |
7.71 |
-8.73 |
-0.58 |
0 |
|
|
364225 |
127314529 |
1 |
O4N5C16H25 |
A4B5C16D25 |
-163.75 |
4.64 |
-8.9 |
-0.58 |
0 |
|
|
364226 |
127314530 |
1 |
N3O3C13H21 |
A3B3C13D21 |
-159.82 |
3.54 |
-9.49 |
-0.1 |
0 |
|
|
364227 |
127314531 |
1 |
ON2C13H24 |
AB2C13D24 |
-67.65 |
5.09 |
-8.54 |
1.28 |
0 |
|
|
364228 |
127314532 |
2 |
NOC7H10 |
ABC7D10 |
-86.12 |
6.26 |
-8.98 |
-0.64 |
0 |
|
|
364229 |
127314533 |
1 |
SN2O3C11H22 |
AB2C3D11E22 |
-154.18 |
7.13 |
-9.22 |
0.41 |
0 |
|
|
364230 |
127314534 |
1 |
N3O3C16H19 |
A3B3C16D19 |
-58.35 |
7.52 |
-9.65 |
-1.68 |
0 |
|
|
364231 |
127314535 |
1 |
N3O3C12H19 |
A3B3C12D19 |
-148.12 |
5.13 |
-9.65 |
-0.1 |
0 |
|
|
364232 |
127314536 |
1 |
NO2C13H23 |
AB2C13D23 |
-128.24 |
2.82 |
-9.18 |
1.01 |
0 |
|
|
364233 |
127314537 |
2 |
ON3C9H10 |
AB3C9D10 |
-5.31 |
7.55 |
-9.2 |
-0.97 |
0 |
|
|
364234 |
127314538 |
1 |
ON5C20H25 |
AB5C20D25 |
24.44 |
6.63 |
-8.56 |
-0.58 |
0 |
|
|
364235 |
127314539 |
2 |
ON2C10H12 |
AB2C10D12 |
-26.91 |
0.72 |
-9.4 |
-0.6 |
0 |
|
|
364236 |
127314540 |
1 |
ON5C12H13 |
AB5C12D13 |
24.61 |
2.42 |
-9.63 |
-0.68 |
0 |
|
|
364237 |
127314541 |
1 |
O2N3C18H19 |
A2B3C18D19 |
-39.49 |
7.95 |
-9.19 |
-0.41 |
0 |
|
|
364238 |
127314542 |
1 |
N3O3C18H19 |
A3B3C18D19 |
-72.42 |
4.05 |
-8.78 |
-0.56 |
0 |
|
|
364239 |
127314543 |
1 |
O2N4C19H20 |
A2B4C19D20 |
-28.84 |
3.07 |
-9.41 |
-0.73 |
0 |
|
|
364240 |
127314544 |
1 |
O3N4C19H20 |
A3B4C19D20 |
-61.83 |
4.08 |
-9.23 |
-0.63 |
0 |
|
|
364241 |
127314545 |
1 |
O2N5C22H23 |
A2B5C22D23 |
-0.35 |
2.38 |
-8.28 |
-0.71 |
0 |
|
|
364242 |
127314546 |
1 |
O2N4C21H28 |
A2B4C21D28 |
-83.85 |
4.6 |
-9.73 |
-0.59 |
0 |
|
|
364243 |
127314547 |
1 |
NO4C16H21 |
AB4C16D21 |
-151.45 |
7.12 |
-8.9 |
-0.52 |
0 |
|
|
364244 |
127314548 |
1 |
N2O3C14H24 |
A2B3C14D24 |
-147.83 |
5.44 |
-9.76 |
0.6 |
0 |
|
|
364245 |
127314549 |
1 |
N3O3C20H27 |
A3B3C20D27 |
-114.17 |
1.27 |
-8.74 |
0.05 |
0 |
|
|
364246 |
127314550 |
1 |
SN3O3C15H27 |
AB3C3D15E27 |
-141.84 |
5.78 |
-8.34 |
0.74 |
0 |
|
|
364247 |
127314551 |
1 |
OSN2C12H22 |
ABC2D12E22 |
-55.83 |
6.03 |
-8.29 |
1.05 |
0 |
|
|
364248 |
127314552 |
1 |
SO2N3C14H25 |
AB2C3D14E25 |
-106.01 |
4.44 |
-8.48 |
0.81 |
0 |
|
|
364249 |
127314553 |
1 |
O3N4C19H34 |
A3B4C19D34 |
-147.53 |
7.99 |
-8.78 |
0.64 |
0 |
|
|
364250 |
127314554 |
1 |
BrO2N5C14H16 |
AB2C5D14E16 |
-22.19 |
4.4 |
-9.42 |
-0.96 |
0 |
|
|
364251 |
127314555 |
1 |
O2N5C19H23 |
A2B5C19D23 |
-28.43 |
6.82 |
-9.82 |
-0.16 |
0 |
|
|
364252 |
127314556 |
1 |
O2N3C19H29 |
A2B3C19D29 |
-59.86 |
6.75 |
-8.66 |
0.9 |
0 |
|
|
364253 |
127314557 |
1 |
SO3N4C15H30 |
AB3C4D15E30 |
-131.54 |
5.32 |
-8.71 |
-0.09 |
0 |
|
|
364254 |
127314558 |
1 |
ON2C15H28 |
AB2C15D28 |
-57.6 |
3.67 |
-8.28 |
2.6 |
0 |
|
|
364255 |
127314559 |
1 |
N3O4C16H25 |
A3B4C16D25 |
-182.67 |
2.57 |
-8.74 |
-0.2 |
0 |
|
|
364256 |
127314560 |
1 |
ON2C13H24 |
AB2C13D24 |
-72.02 |
3.68 |
-8.43 |
1.18 |
0 |
|
|
364257 |
127314561 |
1 |
ON2C12H24 |
AB2C12D24 |
-73.2 |
3.77 |
-8.56 |
1.22 |
0 |
|
|
364258 |
127314739 |
1 |
O2N6C19H32 |
A2B6C19D32 |
-68.09 |
5.61 |
-8.97 |
0.78 |
0 |
|
|
364259 |
127314740 |
1 |
O2N5C18H29 |
A2B5C18D29 |
-91.87 |
7.8 |
-8.76 |
0.76 |
0 |
|
|
364260 |
127314741 |
1 |
O3N5C19H25 |
A3B5C19D25 |
-74.31 |
10.44 |
-8.39 |
-0.2 |
0 |
|
|
364261 |
127314742 |
1 |
ClN3O3C18H26 |
AB3C3D18E26 |
-114.38 |
4.67 |
-8.92 |
-0.41 |
0 |
|
|
364262 |
127315311 |
1 |
NSO3C15H25 |
ABC3D15E25 |
-161.19 |
7.69 |
-9.46 |
0.81 |
0 |
|
|
364263 |
127315312 |
1 |
ON3C17H25 |
AB3C17D25 |
-31.37 |
5.86 |
-8.93 |
0.53 |
0 |
|
|
364264 |
127315313 |
1 |
N2O3C20H28 |
A2B3C20D28 |
-130.31 |
5.57 |
-9.6 |
-0.04 |
0 |
|
|
364265 |
127315314 |
1 |
NSO3C12H23 |
ABC3D12E23 |
-161.71 |
7.89 |
-9.57 |
0.82 |
0 |
|
|
364266 |
127315315 |
1 |
NOC13H25 |
ABC13D25 |
-91.53 |
4.32 |
-9.06 |
1.45 |
0 |
|
|
364267 |
127315333 |
2 |
ON2C8H13 |
AB2C8D13 |
-80.48 |
3.11 |
-9.45 |
0.57 |
0 |
|
|
364268 |
127315334 |
1 |
SN3O3C15H19 |
AB3C3D15E19 |
-87.13 |
9.84 |
-8.88 |
-1.25 |
0 |
|
|
364270 |
127315352 |
1 |
O2N3C17H27 |
A2B3C17D27 |
-81.44 |
6.33 |
-9.43 |
0.08 |
0 |
|
|
364271 |
127315353 |
1 |
SN2O5C17H24 |
AB2C5D17E24 |
-191.04 |
4.85 |
-9.52 |
-1.06 |
0 |
|
|
364272 |
127315354 |
1 |
SN3O5C17H27 |
AB3C5D17E27 |
-190.9 |
4.07 |
-9.63 |
-0.43 |
0 |
|
|
364273 |
127315355 |
1 |
SN2O4C12H22 |
AB2C4D12E22 |
-186.67 |
4.29 |
-9.45 |
0.16 |
0 |
|
|
364274 |
127315356 |
1 |
N3O3C15H17 |
A3B3C15D17 |
-36.58 |
1.64 |
-9.78 |
-1.38 |
0 |
|
|
364275 |
127315357 |
1 |
N3O4C16H25 |
A3B4C16D25 |
-199.34 |
7.85 |
-9.62 |
-0.31 |
0 |
|
|
364276 |
127315358 |
1 |
N3O4C15H23 |
A3B4C15D23 |
-192.57 |
5.86 |
-9.57 |
-0.3 |
0 |
|
|
364277 |
127315359 |
1 |
N3O4C18H31 |
A3B4C18D31 |
-193.92 |
3.87 |
-8.96 |
0.82 |
0 |
|
|
364278 |
127315360 |
1 |
N2S3O4C15H22 |
A2B3C4D15E22 |
-149.13 |
3.89 |
-8.8 |
-1.47 |
0 |
|
|
364279 |
127315378 |
1 |
NSO3C11H21 |
ABC3D11E21 |
-159.46 |
7.63 |
-9.65 |
0.62 |
0 |
|
|
364280 |
127315379 |
1 |
SN3O4C19H27 |
AB3C4D19E27 |
-173.17 |
8.59 |
-10.03 |
-0.43 |
0 |
|
|
364281 |
127315380 |
1 |
SN2O4C17H30 |
AB2C4D17E30 |
-193.9 |
4.18 |
-9.02 |
0.51 |
0 |
|
|
364282 |
127315381 |
1 |
SN2O4C17H30 |
AB2C4D17E30 |
-196.94 |
3.97 |
-9.12 |
0.45 |
0 |
|
|
364283 |
127315382 |
1 |
N3O3C18H29 |
A3B3C18D29 |
-95.12 |
3.65 |
-8.75 |
0.14 |
0 |
|
|
364284 |
127315383 |
1 |
N3O3C18H31 |
A3B3C18D31 |
-137.61 |
4.91 |
-9.11 |
0.54 |
0 |
|
|
364285 |
127315384 |
1 |
SN3O5C18H29 |
AB3C5D18E29 |
-186.45 |
2.25 |
-9.15 |
-0.49 |
0 |
|
|
364286 |
127315385 |
1 |
SN3O5C18H29 |
AB3C5D18E29 |
-188.77 |
4.23 |
-9.23 |
-0.54 |
0 |
|
|
364287 |
127315386 |
1 |
SN3O5C18H29 |
AB3C5D18E29 |
-223.1 |
6.44 |
-9.82 |
0.49 |
0 |
|
|
364288 |
127315387 |
1 |
N3O3C20H35 |
A3B3C20D35 |
-164.45 |
5.98 |
-8.83 |
0.81 |
0 |
|
|
364289 |
127315388 |
1 |
N3O3C20H35 |
A3B3C20D35 |
-163.27 |
3.43 |
-8.92 |
0.7 |
0 |