List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
122312 |
50802028 |
1 |
SO3N4C25H32 |
AB3C4D25E32 |
-60.18 |
6.27 |
-8.9 |
-0.74 |
0 |
|
|
122313 |
50802100 |
1 |
SO3N4C25H26 |
AB3C4D25E26 |
-40.93 |
4.4 |
-8.35 |
-0.92 |
0 |
|
|
122314 |
50802101 |
1 |
SO2N4C15H18 |
AB2C4D15E18 |
-17.38 |
2.75 |
-8.76 |
-0.68 |
0 |
|
|
122315 |
50802102 |
1 |
ClO2N4H19C21 |
AB2C4D19E21 |
-6.12 |
4.78 |
-8.58 |
-0.42 |
0 |
|
|
122316 |
50802103 |
1 |
ClSO2N4C15H17 |
ABC2D4E15F17 |
-26.16 |
5.79 |
-8.94 |
-1.02 |
0 |
|
|
122317 |
50802121 |
1 |
FN3O4H20C24 |
AB3C4D20E24 |
-110.34 |
4.42 |
-8.58 |
-1.02 |
0 |
|
|
122318 |
50802164 |
1 |
N3O4H23C25 |
A3B4C23D25 |
-76.82 |
6.15 |
-8.44 |
-0.96 |
0 |
|
|
122319 |
50802165 |
1 |
FN3O4H20C24 |
AB3C4D20E24 |
-110.44 |
8.4 |
-8.79 |
-1.06 |
0 |
|
|
122320 |
50802426 |
1 |
ClO2S2N6H17C20 |
AB2C2D6E17F20 |
23.84 |
2.57 |
-8.91 |
-1.53 |
0 |
|
|
122321 |
50802494 |
1 |
N3O4C16H19 |
A3B4C16D19 |
-115.91 |
4.54 |
-9.02 |
-0.98 |
0 |
|
|
122322 |
50802733 |
1 |
N3O3H23C25 |
A3B3C23D25 |
2.67 |
4.16 |
-8.43 |
-0.25 |
0 |
|
|
122323 |
50802744 |
1 |
SO2N3C21H27 |
AB2C3D21E27 |
-37.96 |
3.2 |
-9.0 |
-0.94 |
0 |
|
|
122324 |
50802767 |
1 |
SO2N3H21C22 |
AB2C3D21E22 |
17.74 |
3.68 |
-8.83 |
-1.03 |
0 |
|
|
122325 |
50802831 |
1 |
ClSO3N5H22C24 |
ABC3D5E22F24 |
-5.35 |
6.26 |
-9.1 |
-1.4 |
0 |
|
|
122326 |
50802842 |
1 |
BrSO2N5H22C24 |
ABC2D5E22F24 |
37.78 |
6.29 |
-9.14 |
-1.25 |
0 |
|
|
122327 |
50802843 |
1 |
SO3N5C26H27 |
AB3C5D26E27 |
-9.49 |
3.68 |
-9.02 |
-1.3 |
0 |
|
|
122328 |
50802854 |
1 |
FSO3N5H24C25 |
ABC3D5E24F25 |
-52.72 |
6.53 |
-8.94 |
-1.54 |
0 |
|
|
122329 |
50802855 |
1 |
FSO2N5H20C23 |
ABC2D5E20F23 |
-3.25 |
4.9 |
-9.05 |
-1.49 |
0 |
|
|
122330 |
50802856 |
1 |
BrFSO2N5H19C23 |
ABCD2E5F19G23 |
-0.72 |
4.74 |
-9.18 |
-1.55 |
0 |
|
|
122331 |
50802857 |
1 |
FSO2N5H22C24 |
ABC2D5E22F24 |
-11.09 |
4.7 |
-9.1 |
-1.48 |
0 |
|
|
122332 |
50802887 |
1 |
BrO2S2N5H18C21 |
AB2C2D5E18F21 |
51.58 |
4.86 |
-9.15 |
-1.64 |
0 |
|
|
122333 |
50802888 |
1 |
SO3N5C26H27 |
AB3C5D26E27 |
-9.84 |
4.11 |
-9.0 |
-1.52 |
0 |
|
|
122334 |
50802889 |
1 |
FSO3N5H22C24 |
ABC3D5E22F24 |
-44.51 |
4.72 |
-9.05 |
-1.32 |
0 |
|
|
122335 |
50803074 |
1 |
SO3N5C26H27 |
AB3C5D26E27 |
-12.8 |
7.43 |
-9.03 |
-1.16 |
0 |
|
|
122336 |
50803105 |
1 |
SO3N5C25H25 |
AB3C5D25E25 |
-5.59 |
4.36 |
-9.12 |
-1.32 |
0 |
|
|
122337 |
50803112 |
1 |
ClFSO3N5H21C24 |
ABCD3E5F21G24 |
-48.98 |
4.24 |
-9.22 |
-1.47 |
0 |
|
|
122338 |
50803224 |
1 |
ClSO4N5H24C25 |
ABC4D5E24F25 |
-39.98 |
7.39 |
-8.6 |
-1.52 |
0 |
|
|
122339 |
50803325 |
1 |
FSO3N6H23C24 |
ABC3D6E23F24 |
-41.82 |
6.28 |
-8.96 |
-1.52 |
0 |
|
|
122340 |
50803390 |
1 |
SO3N6C26H28 |
AB3C6D26E28 |
-15.58 |
5.9 |
-8.46 |
-1.32 |
0 |
|
|
122341 |
50803391 |
1 |
SO3N4C22H22 |
AB3C4D22E22 |
-3.65 |
6.26 |
-8.62 |
-1.11 |
0 |
|
|
122342 |
50803392 |
1 |
SO2N4H20C21 |
AB2C4D20E21 |
41.32 |
2.87 |
-8.74 |
-1.26 |
0 |
|
|
122343 |
50803393 |
1 |
FOSN4C20H25 |
ABCD4E20F25 |
-27.69 |
5.44 |
-9.24 |
-1.12 |
0 |
|
|
122344 |
50803414 |
1 |
FSO4N6H23C25 |
ABC4D6E23F25 |
-89.91 |
2.91 |
-9.24 |
-1.69 |
0 |
|
|
122345 |
50803437 |
1 |
ClO2S2N6H23C24 |
AB2C2D6E23F24 |
34.7 |
4.45 |
-8.45 |
-1.33 |
0 |
|
|
122346 |
50803448 |
1 |
O2S3N6C22H22 |
A2B3C6D22E22 |
47.51 |
4.2 |
-8.44 |
-1.58 |
0 |
|
|
122347 |
50803504 |
1 |
SF2O2N6H20C23 |
AB2C2D6E20F23 |
-50.96 |
3.81 |
-8.89 |
-1.58 |
0 |
|
|
122348 |
50803529 |
1 |
OSN4C23H32 |
ABC4D23E32 |
2.5 |
4.15 |
-8.99 |
-1.08 |
0 |
|
|
122349 |
50803562 |
1 |
OSN4C23H32 |
ABC4D23E32 |
1.04 |
4.67 |
-8.77 |
-1.06 |
0 |
|
|
122350 |
50803563 |
1 |
ClSO2N6C25H25 |
ABC2D6E25F25 |
17.19 |
4.41 |
-8.6 |
-1.67 |
0 |
|
|
122351 |
50803564 |
1 |
ClSO2N6C25H25 |
ABC2D6E25F25 |
13.46 |
4.79 |
-8.7 |
-1.69 |
0 |
|
|
122352 |
50803565 |
1 |
FSO2N6C25H25 |
ABC2D6E25F25 |
-22.58 |
5.33 |
-8.45 |
-1.6 |
0 |
|
|
122353 |
50803574 |
1 |
O2S2N6C23H24 |
A2B2C6D23E24 |
31.62 |
4.11 |
-8.56 |
-1.6 |
0 |
|
|
122354 |
50803575 |
1 |
FSO3N6H23C24 |
ABC3D6E23F24 |
-45.79 |
4.43 |
-9.12 |
-1.59 |
0 |
|
|
122355 |
50803576 |
1 |
ClSO3N6H23C24 |
ABC3D6E23F24 |
-6.14 |
2.48 |
-8.93 |
-1.63 |
0 |
|
|
122356 |
50803614 |
1 |
FOSN4H21C23 |
ABCD4E21F23 |
48.65 |
5.75 |
-9.39 |
-1.26 |
0 |
|
|
122357 |
50803615 |
1 |
ClSO2N4C18H21 |
ABC2D4E18F21 |
-9.55 |
4.57 |
-9.24 |
-1.33 |
0 |
|
|
122358 |
50803677 |
1 |
FOSN4H21C26 |
ABCD4E21F26 |
58.3 |
4.12 |
-9.12 |
-1.39 |
0 |
|
|
122359 |
50803678 |
1 |
ClSO2N4C22H27 |
ABC2D4E22F27 |
-20.63 |
5.47 |
-9.33 |
-1.2 |
0 |
|
|
122360 |
50803679 |
1 |
ClSO2N4H21C22 |
ABC2D4E21F22 |
29.14 |
6.15 |
-9.36 |
-1.51 |
0 |
|
|
122361 |
50803698 |
1 |
SO3N6C26H28 |
AB3C6D26E28 |
-13.52 |
6.64 |
-8.51 |
-1.24 |
0 |
|
|
122362 |
50803823 |
2 |
NOC11H13 |
ABC11D13 |
-64.26 |
6.27 |
-8.81 |
0.07 |
0 |
|
|
122363 |
50803905 |
1 |
ClFN2O2C20H20 |
ABC2D2E20F20 |
-107.31 |
5.24 |
-8.82 |
-0.44 |
0 |
|
|
122364 |
50803909 |
1 |
O2N4C27H36 |
A2B4C27D36 |
-57.9 |
7.3 |
-8.29 |
-0.03 |
0 |
|
|
122365 |
50803911 |
1 |
F2N2O2C21H22 |
A2B2C2D21E22 |
-157.16 |
3.74 |
-8.89 |
-0.74 |
0 |
|
|
122366 |
50803912 |
1 |
ClN2O2C25H25 |
AB2C2D25E25 |
-54.96 |
3.19 |
-8.85 |
-0.64 |
0 |
|
|
122367 |
50803913 |
2 |
NOC13H14 |
ABC13D14 |
-54.04 |
3.97 |
-8.28 |
-0.32 |
0 |
|
|
122368 |
50803930 |
4 |
NOC7H10 |
ABC7D10 |
-169.68 |
1.88 |
-8.81 |
0.07 |
0 |
|
|
122369 |
50804001 |
1 |
N3O3C23H31 |
A3B3C23D31 |
-116.47 |
3.07 |
-8.76 |
0.04 |
0 |
|
|
122370 |
50804002 |
1 |
N3O3C19H31 |
A3B3C19D31 |
-152.49 |
4.0 |
-8.7 |
0.07 |
0 |
|
|
122371 |
50804003 |
1 |
ClN2O3C19H23 |
AB2C3D19E23 |
-137.33 |
5.2 |
-8.74 |
-0.18 |
0 |
|
|
122372 |
50804004 |
1 |
N2O3C20H26 |
A2B3C20D26 |
-127.06 |
5.47 |
-9.01 |
0.05 |
0 |
|
|
122373 |
50804005 |
1 |
N2O4C17H26 |
A2B4C17D26 |
-197.65 |
2.97 |
-9.07 |
-0.01 |
0 |
|
|
122374 |
50804006 |
1 |
N2O3C19H24 |
A2B3C19D24 |
-127.28 |
3.55 |
-8.58 |
-0.04 |
0 |
|
|
122375 |
50804007 |
1 |
BrN2O3C19H23 |
AB2C3D19E23 |
-117.19 |
3.72 |
-9.09 |
-0.3 |
0 |
|
|
122376 |
50804008 |
1 |
ClN3O4C21H22 |
AB3C4D21E22 |
-98.33 |
7.17 |
-9.26 |
-0.62 |
0 |
|
|
122377 |
50804009 |
1 |
FN3O4C21H22 |
AB3C4D21E22 |
-136.79 |
6.13 |
-9.3 |
-0.51 |
0 |
|
|
122378 |
50804010 |
1 |
N3O5C22H33 |
A3B5C22D33 |
-235.71 |
4.3 |
-9.0 |
0.04 |
0 |
|
|
122379 |
50804011 |
1 |
N4O5C25H38 |
A4B5C25D38 |
-250.67 |
8.83 |
-8.91 |
0.14 |
0 |
|
|
122380 |
50804012 |
1 |
O4N5C25H41 |
A4B5C25D41 |
-197.92 |
6.69 |
-8.59 |
0.14 |
0 |
|
|
122381 |
50804013 |
1 |
N4O4C27H44 |
A4B4C27D44 |
-217.3 |
5.06 |
-8.87 |
0.14 |
0 |
|
|
122382 |
50804014 |
1 |
FN2O3C21H23 |
AB2C3D21E23 |
-133.59 |
8.31 |
-9.09 |
-0.04 |
0 |
|
|
122383 |
50804113 |
1 |
N2O3C26H28 |
A2B3C26D28 |
-78.97 |
3.98 |
-8.62 |
-0.25 |
0 |
|
|
122384 |
50804236 |
1 |
SO3N4C25H26 |
AB3C4D25E26 |
-9.81 |
3.36 |
-7.91 |
-1.15 |
0 |
|
|
122385 |
50804237 |
1 |
SN4O4C25H26 |
AB4C4D25E26 |
-42.91 |
5.2 |
-8.0 |
-1.03 |
0 |
|
|
122386 |
50804433 |
1 |
SO3N4C26H28 |
AB3C4D26E28 |
-16.12 |
5.71 |
-7.86 |
-1.1 |
0 |