List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
416283 |
135089295 |
1 |
SN2O2C18H22 |
AB2C2D18E22 |
-45.66 |
3.07 |
-9.03 |
-0.26 |
0 |
|
|
416284 |
135089296 |
1 |
O2N4C19H24 |
A2B4C19D24 |
-22.24 |
6.3 |
-9.09 |
-0.46 |
0 |
|
|
416285 |
135089297 |
1 |
FO3N4C16H21 |
AB3C4D16E21 |
-87.69 |
4.63 |
-9.07 |
-1.0 |
0 |
|
|
416286 |
135089298 |
1 |
N2S2O5C15H24 |
A2B2C5D15E24 |
-199.5 |
8.83 |
-9.5 |
-0.68 |
0 |
|
|
416287 |
135089299 |
1 |
Cl2O2N3C14H15 |
A2B2C3D14E15 |
-55.39 |
9.06 |
-8.87 |
-0.89 |
0 |
|
|
416288 |
135089301 |
1 |
ClON3C16H24 |
ABC3D16E24 |
-40.21 |
2.48 |
-8.51 |
-0.1 |
0 |
|
|
416289 |
135089302 |
1 |
ON5C15H25 |
AB5C15D25 |
58.85 |
3.95 |
-8.64 |
0.02 |
0 |
|
|
416290 |
135089303 |
1 |
SO3N4C17H26 |
AB3C4D17E26 |
-121.74 |
1.67 |
-9.26 |
-0.31 |
0 |
|
|
416291 |
135089304 |
1 |
ClO5N6C37H45 |
AB5C6D37E45 |
-183.35 |
9.81 |
-8.76 |
-0.5 |
0 |
|
|
416292 |
135089305 |
1 |
O3N4C19H26 |
A3B4C19D26 |
-70.16 |
4.58 |
-8.97 |
-0.41 |
0 |
|
|
416293 |
135089306 |
2 |
N3O3C18H22 |
A3B3C18D22 |
-217.19 |
5.99 |
-9.58 |
-1.12 |
0 |
|
|
416295 |
135089308 |
1 |
N2O3C20H28 |
A2B3C20D28 |
-65.6 |
2.16 |
-8.97 |
0.26 |
0 |
|
|
416296 |
135089309 |
1 |
SO2N3C14H19 |
AB2C3D14E19 |
-47.01 |
3.9 |
-8.87 |
-0.06 |
0 |
|
|
416297 |
135089310 |
1 |
N3O3C16H21 |
A3B3C16D21 |
-100.83 |
8.1 |
-9.71 |
-0.19 |
0 |
|
|
416298 |
135089311 |
1 |
O5N7C34H45 |
A5B7C34D45 |
-172.82 |
12.52 |
-8.71 |
-0.41 |
0 |
|
|
416299 |
135089312 |
2 |
ON2C12H14 |
AB2C12D14 |
-26.56 |
4.96 |
-9.14 |
-0.7 |
0 |
|
|
416300 |
135089313 |
1 |
NO4C23H27 |
AB4C23D27 |
-143.99 |
5.41 |
-8.97 |
0.03 |
0 |
|
|
416301 |
135089314 |
1 |
ON5C14H21 |
AB5C14D21 |
9.63 |
3.89 |
-9.35 |
-0.43 |
0 |
|
|
416302 |
135089315 |
1 |
NF2O2C18H21 |
AB2C2D18E21 |
-170.99 |
4.87 |
-9.41 |
-0.44 |
0 |
|
|
416303 |
135089316 |
2 |
FNOC9H12 |
ABCD9E12 |
-172.05 |
4.13 |
-9.03 |
-0.67 |
0 |
|
|
416304 |
135089317 |
1 |
N2O5C17H24 |
A2B5C17D24 |
-205.24 |
4.3 |
-9.38 |
-0.42 |
0 |
|
|
416305 |
135089318 |
1 |
N5O5H15C16 |
A5B5C15D16 |
-76.54 |
6.52 |
-10.1 |
-1.57 |
0 |
|
|
416306 |
135089319 |
1 |
NSO5C16H29 |
ABC5D16E29 |
-260.64 |
5.56 |
-9.49 |
0.65 |
0 |
|
|
416307 |
135089320 |
1 |
N2O3C15H22 |
A2B3C15D22 |
-106.93 |
5.04 |
-9.09 |
0.38 |
0 |
|
|
416308 |
135089321 |
1 |
O2S2N5C14H17 |
A2B2C5D14E17 |
-2.17 |
5.51 |
-9.04 |
-1.25 |
0 |
|
|
416309 |
135089322 |
1 |
ON4C13H18 |
AB4C13D18 |
10.67 |
3.9 |
-9.04 |
0.32 |
0 |
|
|
416310 |
135089323 |
2 |
ON2C9H14 |
AB2C9D14 |
-68.12 |
5.06 |
-9.24 |
-0.58 |
0 |
|
|
416311 |
135089324 |
2 |
ON2C10H13 |
AB2C10D13 |
-16.38 |
1.36 |
-8.65 |
0.13 |
0 |
|
|
416312 |
135089325 |
1 |
SN2O3C19H24 |
AB2C3D19E24 |
-100.35 |
4.22 |
-9.15 |
-0.4 |
0 |
|
|
416313 |
135089326 |
1 |
N3O4C22H27 |
A3B4C22D27 |
-148.44 |
5.78 |
-8.75 |
-0.16 |
0 |
|
|
416314 |
135089327 |
1 |
N3O3C15H25 |
A3B3C15D25 |
-114.08 |
9.69 |
-9.45 |
0.52 |
0 |
|
|
416315 |
135089328 |
1 |
SO5N6C32H38 |
AB5C6D32E38 |
-149.81 |
8.61 |
-9.29 |
-0.92 |
0 |
|
|
416316 |
135089329 |
1 |
ClNO3C19H26 |
ABC3D19E26 |
-134.11 |
3.1 |
-9.03 |
-0.26 |
0 |
|
|
416317 |
135089330 |
1 |
OCl2N3C14H21 |
AB2C3D14E21 |
-28.4 |
3.07 |
-8.57 |
-0.53 |
0 |
|
|
416318 |
135089331 |
1 |
N2O5C25H30 |
A2B5C25D30 |
-163.89 |
5.77 |
-8.32 |
-0.33 |
0 |
|
|
416319 |
135089332 |
1 |
NSO4C21H25 |
ABC4D21E25 |
-119.75 |
4.37 |
-8.39 |
-0.22 |
0 |
|
|
416320 |
135089333 |
1 |
FSO3N4C13H21 |
ABC3D4E13F21 |
-139.11 |
4.36 |
-9.5 |
-0.61 |
0 |
|
|
416321 |
135089334 |
1 |
OSN4C19H22 |
ABC4D19E22 |
19.18 |
3.85 |
-8.72 |
-0.76 |
0 |
|
|
416322 |
135089335 |
1 |
ON6C21H26 |
AB6C21D26 |
24.83 |
0.34 |
-8.35 |
0.0 |
0 |
|
|
416323 |
135089336 |
2 |
O3N4C18H22 |
A3B4C18D22 |
-174.89 |
13.12 |
-9.43 |
-0.66 |
0 |
|
|
416324 |
135089337 |
1 |
ClN3O3C19H28 |
AB3C3D19E28 |
-103.3 |
5.22 |
-8.52 |
-0.23 |
0 |
|
|
416325 |
135089338 |
1 |
SO4N7C32H41 |
AB4C7D32E41 |
-113.78 |
5.29 |
-9.05 |
-0.43 |
0 |
|
|
416326 |
135089339 |
1 |
FO2N4C19H23 |
AB2C4D19E23 |
-80.45 |
4.87 |
-9.37 |
-0.99 |
0 |
|
|
416327 |
135089340 |
1 |
ON5H15C18 |
AB5C15D18 |
81.02 |
4.56 |
-9.37 |
-1.07 |
0 |
|
|
416328 |
135089341 |
1 |
ClN2O3C16H17 |
AB2C3D16E17 |
-104.34 |
6.32 |
-9.37 |
-1.25 |
0 |
|
|
416329 |
135089342 |
1 |
NSO4C16H25 |
ABC4D16E25 |
-163.72 |
5.45 |
-8.68 |
-0.45 |
0 |
|
|
416330 |
135089343 |
1 |
ON5C16H27 |
AB5C16D27 |
-42.92 |
4.46 |
-8.72 |
0.34 |
0 |
|
|
416331 |
135089344 |
1 |
O3N4C19H22 |
A3B4C19D22 |
-41.23 |
6.97 |
-8.83 |
-0.41 |
0 |
|
|
416332 |
135089345 |
1 |
FNO4C22H24 |
ABC4D22E24 |
-192.82 |
3.05 |
-9.7 |
-0.36 |
0 |
|
|
416333 |
135089346 |
1 |
N3O5C18H25 |
A3B5C18D25 |
-192.31 |
2.59 |
-8.63 |
-0.01 |
0 |
|
|
416334 |
135089347 |
1 |
N4O4C17H20 |
A4B4C17D20 |
-138.81 |
4.93 |
-9.91 |
-0.91 |
0 |
|
|
416335 |
135089348 |
1 |
N4O4C17H20 |
A4B4C17D20 |
-140.72 |
4.83 |
-9.93 |
-0.92 |
0 |
|
|
416336 |
135089349 |
1 |
O2F3N3C18H22 |
A2B3C3D18E22 |
-166.29 |
5.67 |
-9.49 |
-0.98 |
0 |
|
|
416337 |
135089350 |
1 |
FON5C18H22 |
ABC5D18E22 |
-15.53 |
4.36 |
-8.49 |
-0.32 |
0 |
|
|
416338 |
135089351 |
1 |
ClN3O3C16H18 |
AB3C3D16E18 |
-32.87 |
5.34 |
-9.42 |
-1.1 |
0 |
|
|
416339 |
135089352 |
1 |
NO5C20H29 |
AB5C20D29 |
-186.37 |
2.93 |
-8.12 |
0.35 |
0 |
|
|
416340 |
135089353 |
1 |
ClFON4H16C18 |
ABCD4E16F18 |
-10.74 |
4.0 |
-9.14 |
-1.06 |
0 |
|
|
416341 |
135089354 |
1 |
N4O4C21H26 |
A4B4C21D26 |
-95.14 |
1.56 |
-9.55 |
-1.05 |
0 |
|
|
416342 |
135089355 |
1 |
SO6N7C37H49 |
AB6C7D37E49 |
-191.68 |
8.3 |
-8.68 |
-0.64 |
0 |
|
|
416343 |
135089356 |
1 |
N2O3C20H28 |
A2B3C20D28 |
-129.18 |
6.78 |
-9.21 |
-0.21 |
0 |
|
|
416344 |
135089357 |
1 |
SO2N5C14H19 |
AB2C5D14E19 |
-33.0 |
4.91 |
-8.88 |
-0.61 |
0 |
|
|
416346 |
135089359 |
1 |
ClO2N5C19H24 |
AB2C5D19E24 |
-6.38 |
3.92 |
-8.61 |
-0.35 |
0 |
|
|
416347 |
135089360 |
1 |
NSO4C21H23 |
ABC4D21E23 |
-74.16 |
4.06 |
-9.14 |
-0.49 |
0 |
|
|
416349 |
135089362 |
1 |
O2N7C13H23 |
A2B7C13D23 |
-17.06 |
4.69 |
-9.19 |
-0.52 |
0 |
|
|
416350 |
135089363 |
1 |
Cl2N2O2C17H22 |
A2B2C2D17E22 |
-96.94 |
3.92 |
-9.1 |
-0.41 |
0 |
|
|
416351 |
135089364 |
1 |
S2N3O5C12H17 |
A2B3C5D12E17 |
-173.77 |
6.57 |
-9.55 |
-1.06 |
0 |
|
|
416352 |
135089365 |
1 |
O2N3C11H17 |
A2B3C11D17 |
-50.22 |
4.71 |
-9.62 |
0.21 |
0 |
|
|
416353 |
135089366 |
1 |
NO3C23H33 |
AB3C23D33 |
-98.51 |
2.52 |
-8.59 |
0.27 |
0 |
|
|
416354 |
135089367 |
1 |
O2N5C15H23 |
A2B5C15D23 |
28.01 |
2.19 |
-8.86 |
-0.5 |
0 |
|
|
416355 |
135089368 |
1 |
ON5C18H23 |
AB5C18D23 |
2.89 |
5.24 |
-8.58 |
-0.06 |
0 |
|
|
416356 |
135089369 |
1 |
N3O4C16H21 |
A3B4C16D21 |
-99.48 |
2.64 |
-8.69 |
-0.22 |
0 |
|
|
416357 |
135089370 |
1 |
N2O2C19H22 |
A2B2C19D22 |
-56.67 |
6.23 |
-9.22 |
-1.03 |
0 |
|
|
416358 |
135089371 |
1 |
NO4C21H27 |
AB4C21D27 |
-144.85 |
6.25 |
-9.27 |
0.22 |
0 |
|
|
416359 |
135089372 |
1 |
N2O2C19H26 |
A2B2C19D26 |
-72.82 |
4.64 |
-8.89 |
-0.72 |
0 |
|
|
416360 |
135089373 |
1 |
ClO2N5C17H18 |
AB2C5D17E18 |
21.58 |
5.99 |
-9.54 |
-0.47 |
0 |
|
|
416361 |
135089374 |
1 |
NSO6C15H21 |
ABC6D15E21 |
-250.92 |
11.95 |
-9.49 |
-0.89 |
0 |
|
|
416362 |
135089375 |
1 |
FNSO3C19H20 |
ABCD3E19F20 |
-133.88 |
5.59 |
-9.37 |
-0.42 |
0 |
|
|
416363 |
135089376 |
1 |
O3N4C18H20 |
A3B4C18D20 |
-1.79 |
3.59 |
-9.48 |
-0.93 |
0 |
|
|
416364 |
135089377 |
1 |
O2N4C21H24 |
A2B4C21D24 |
-26.22 |
4.46 |
-9.23 |
-0.55 |
0 |
|
|
416365 |
135089378 |
1 |
NO5C17H25 |
AB5C17D25 |
-207.55 |
6.15 |
-8.36 |
0.26 |
0 |
|
|
416367 |
135089380 |
2 |
NOC9H14 |
ABC9D14 |
-80.79 |
4.06 |
-8.98 |
0.6 |
0 |
|
|
416368 |
135089381 |
1 |
O2N4C19H22 |
A2B4C19D22 |
32.48 |
3.77 |
-9.23 |
-0.38 |
0 |
|
|
416369 |
135089382 |
1 |
SO2N5C19H19 |
AB2C5D19E19 |
46.41 |
7.83 |
-9.28 |
-1.36 |
0 |
|
|
416370 |
135089383 |
1 |
NSO2C18H25 |
ABC2D18E25 |
-28.06 |
4.85 |
-8.78 |
-0.39 |
0 |
|
|
416371 |
135089384 |
1 |
O3N4C16H20 |
A3B4C16D20 |
-64.44 |
2.0 |
-9.2 |
-0.28 |
0 |
|
|
416372 |
135089385 |
1 |
O5N6C30H40 |
A5B6C30D40 |
-191.22 |
4.17 |
-9.5 |
-0.89 |
0 |
|
|
416373 |
135089386 |
1 |
N5O7C32H41 |
A5B7C32D41 |
-263.24 |
6.22 |
-9.09 |
-0.49 |
0 |
|
|
416374 |
135089387 |
1 |
O2N3C23H31 |
A2B3C23D31 |
-64.25 |
2.39 |
-9.31 |
-0.71 |
0 |
|
|
416376 |
135089389 |
1 |
O3N4C17H22 |
A3B4C17D22 |
-82.56 |
8.1 |
-9.11 |
-0.26 |
0 |
|
|
416377 |
135089390 |
1 |
NO2C19H27 |
AB2C19D27 |
-73.81 |
4.45 |
-8.96 |
0.33 |
0 |
|
|
416378 |
135089391 |
1 |
ClO2N3C16H22 |
AB2C3D16E22 |
-101.92 |
6.46 |
-8.72 |
-0.16 |
0 |
|
|
416379 |
135089392 |
1 |
O3N4C19H24 |
A3B4C19D24 |
-92.97 |
6.42 |
-9.21 |
0.02 |
0 |
|
|
416380 |
135089393 |
1 |
N3O3C24H35 |
A3B3C24D35 |
-125.34 |
9.31 |
-8.91 |
0.05 |
0 |
|
|
416381 |
135089394 |
1 |
N3O3C19H25 |
A3B3C19D25 |
-61.34 |
3.1 |
-8.81 |
-1.1 |
0 |
|
|
416382 |
135089395 |
1 |
O3N4C20H20 |
A3B4C20D20 |
-8.89 |
4.83 |
-8.32 |
-0.56 |
0 |
|
|
416383 |
135089396 |
1 |
NO5C20H29 |
AB5C20D29 |
-233.02 |
2.9 |
-9.07 |
0.2 |
0 |
|
|
416384 |
135089397 |
1 |
ClNOC16H22 |
ABCD16E22 |
-52.74 |
1.83 |
-8.84 |
-0.04 |
0 |
|
|
416385 |
135089398 |
1 |
O3N5C18H25 |
A3B5C18D25 |
-6.33 |
7.24 |
-8.74 |
-1.0 |
0 |
|
|
416386 |
135089399 |
1 |
ON6C17H28 |
AB6C17D28 |
4.95 |
2.2 |
-8.59 |
0.52 |
0 |
|
|
416387 |
135089400 |
1 |
N3O5C18H25 |
A3B5C18D25 |
-167.79 |
4.92 |
-8.92 |
-0.12 |
0 |