List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
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 |
|
|
122387 |
50804434 |
1 |
S2N4O5C21H24 |
A2B4C5D21E24 |
-114.99 |
1.65 |
-8.03 |
-1.32 |
0 |
|
|
122388 |
50804436 |
1 |
FSO2N4H21C23 |
ABC2D4E21F23 |
-17.38 |
3.06 |
-8.4 |
-1.42 |
0 |
|
|
122389 |
50804489 |
1 |
SO3N4C26H28 |
AB3C4D26E28 |
-18.43 |
3.66 |
-8.06 |
-1.21 |
0 |
|
|
122390 |
50804490 |
1 |
SN4O4C26H28 |
AB4C4D26E28 |
-48.92 |
3.87 |
-8.01 |
-0.97 |
0 |
|
|
122391 |
50804618 |
1 |
SO2N5H21C22 |
AB2C5D21E22 |
30.38 |
6.3 |
-8.57 |
-1.26 |
0 |
|
|
122392 |
50804635 |
1 |
FSO3N6H23C24 |
ABC3D6E23F24 |
-33.73 |
5.91 |
-8.72 |
-1.16 |
0 |
|
|
122393 |
50804636 |
1 |
BrSO3N4H15C20 |
ABC3D4E15F20 |
23.52 |
8.37 |
-8.92 |
-1.12 |
0 |
|
|
122394 |
50804661 |
1 |
FSO2N4H15C19 |
ABC2D4E15F19 |
2.03 |
6.74 |
-8.94 |
-1.22 |
0 |
|
|
122395 |
50804662 |
1 |
FSO3N5H16C20 |
ABC3D5E16F20 |
-40.58 |
9.87 |
-9.02 |
-1.21 |
0 |
|
|
122396 |
50804858 |
1 |
FOSN5H8C13 |
ABCD5E8F13 |
53.97 |
6.22 |
-9.36 |
-1.5 |
0 |
|
|
122397 |
50804925 |
1 |
FOSN4H15C20 |
ABCD4E15F20 |
57.22 |
8.39 |
-9.12 |
-1.35 |
0 |
|
|
122398 |
50804962 |
1 |
SO3N5H21C22 |
AB3C5D21E22 |
0.51 |
7.06 |
-9.03 |
-1.28 |
0 |
|
|
122399 |
50804981 |
1 |
FOSN4H13C18 |
ABCD4E13F18 |
44.21 |
7.91 |
-8.96 |
-1.26 |
0 |
|
|
122400 |
50804982 |
1 |
OSN4H20C22 |
ABC4D20E22 |
83.51 |
7.37 |
-8.82 |
-0.99 |
0 |
|
|
122401 |
50805002 |
1 |
SO2N5H19C21 |
AB2C5D19E21 |
36.85 |
5.37 |
-9.04 |
-1.23 |
0 |
|
|
122402 |
50805039 |
1 |
O2N5C24H25 |
A2B5C24D25 |
17.75 |
4.5 |
-8.5 |
-0.71 |
0 |
|
|
122403 |
50805053 |
1 |
BrO2N5C22H28 |
AB2C5D22E28 |
-24.26 |
1.76 |
-8.49 |
-0.88 |
0 |
|
|
122404 |
50805157 |
1 |
OF3N5H18C22 |
AB3C5D18E22 |
-80.75 |
4.83 |
-8.83 |
-1.14 |
0 |
|
|
122405 |
50805213 |
1 |
O3N5C21H25 |
A3B5C21D25 |
-62.83 |
4.78 |
-8.4 |
-0.69 |
0 |
|
|
122406 |
50805407 |
1 |
BrO2N3C18H22 |
AB2C3D18E22 |
-14.85 |
4.32 |
-8.97 |
-0.76 |
0 |
|
|
122407 |
50805408 |
1 |
BrN2O3C14H15 |
AB2C3D14E15 |
-49.65 |
1.79 |
-9.86 |
-0.88 |
0 |
|
|
122408 |
50805433 |
1 |
FN2O2H19C20 |
AB2C2D19E20 |
-47.36 |
2.91 |
-9.05 |
-0.84 |
0 |
|
|
122409 |
50805434 |
1 |
BrO2N5H18C19 |
AB2C5D18E19 |
44.87 |
4.68 |
-9.02 |
-0.88 |
0 |
|
|
122410 |
50805435 |
1 |
BrN3O3C22H22 |
AB3C3D22E22 |
-10.36 |
5.52 |
-8.52 |
-0.73 |
0 |
|
|
122411 |
50805436 |
1 |
BrN2O3H17C19 |
AB2C3D17E19 |
-21.68 |
3.81 |
-9.11 |
-0.8 |
0 |
|
|
122412 |
50805437 |
1 |
BrSN2O2H13C16 |
ABC2D2E13F16 |
24.36 |
2.11 |
-9.32 |
-0.82 |
0 |
|
|
122413 |
50805438 |
1 |
BrN2O3C16H19 |
AB2C3D16E19 |
-59.81 |
3.37 |
-9.78 |
-0.88 |
0 |
|
|
122414 |
50805439 |
1 |
N4O5C24H38 |
A4B5C24D38 |
-239.08 |
4.89 |
-9.01 |
0.05 |
0 |
|
|
122415 |
50805504 |
1 |
FN2O2C19H21 |
AB2C2D19E21 |
-62.73 |
6.8 |
-9.48 |
-0.51 |
0 |
|
|
122416 |
50805505 |
1 |
ClFN2O2H14C18 |
ABC2D2E14F18 |
-40.4 |
2.27 |
-9.56 |
-0.75 |
0 |
|
|
122417 |
50805624 |
1 |
FN2O2C17H19 |
AB2C2D17E19 |
-67.38 |
5.58 |
-9.59 |
-0.51 |
0 |
|
|
122418 |
50805696 |
1 |
ClO2N3C22H24 |
AB2C3D22E24 |
-9.52 |
4.55 |
-7.64 |
-0.63 |
0 |
|
|
122419 |
50805697 |
1 |
BrN2O2H15C18 |
AB2C2D15E18 |
13.76 |
3.06 |
-8.75 |
-0.97 |
0 |
|
|
122420 |
50805754 |
1 |
F2N2O2C15H16 |
A2B2C2D15E16 |
-118.94 |
2.75 |
-9.84 |
-0.95 |
0 |
|
|
122421 |
50805756 |
1 |
ClN2O2C19H21 |
AB2C2D19E21 |
-27.05 |
3.37 |
-9.25 |
-0.87 |
0 |
|
|
122422 |
50805777 |
1 |
FN2O3C17H21 |
AB2C3D17E21 |
-115.94 |
3.33 |
-9.73 |
-0.48 |
0 |
|
|
122423 |
50805781 |
1 |
ClN2O2C17H19 |
AB2C2D17E19 |
-27.43 |
6.25 |
-9.58 |
-0.66 |
0 |
|
|
122424 |
50806000 |
1 |
ON4H24C25 |
AB4C24D25 |
58.69 |
4.42 |
-8.44 |
-0.26 |
0 |
|
|
122425 |
50806194 |
1 |
SO2N5C23H23 |
AB2C5D23E23 |
19.13 |
4.47 |
-8.59 |
-1.38 |
0 |
|
|
122426 |
50806232 |
1 |
SN5O5H21C22 |
AB5C5D21E22 |
-66.67 |
7.27 |
-8.26 |
-1.41 |
0 |
|
|
122427 |
50806233 |
1 |
ClSO3N4H17C21 |
ABC3D4E17F21 |
-0.59 |
7.47 |
-8.84 |
-0.96 |
0 |
|
|
122428 |
50806340 |
1 |
SN4O4H18C21 |
AB4C4D18E21 |
-19.86 |
1.7 |
-8.86 |
-1.06 |
0 |
|
|
122429 |
50806341 |
1 |
FSO2N4H15C19 |
ABC2D4E15F19 |
1.51 |
7.35 |
-8.95 |
-1.15 |
0 |
|
|
122430 |
50806342 |
1 |
ClFSO2N4H14C19 |
ABCD2E4F14G19 |
-6.73 |
7.57 |
-8.93 |
-1.11 |
0 |
|
|
122431 |
50806370 |
1 |
SO2N4H20C21 |
AB2C4D20E21 |
29.99 |
6.21 |
-8.87 |
-1.1 |
0 |
|
|
122432 |
50806415 |
1 |
SO2N4H16C19 |
AB2C4D16E19 |
49.31 |
9.63 |
-9.19 |
-1.24 |
0 |
|
|
122433 |
50806913 |
1 |
ON6C27H32 |
AB6C27D32 |
39.61 |
4.32 |
-8.54 |
-0.2 |
0 |
|
|
122434 |
50806949 |
1 |
FSN2O4H21C22 |
ABC2D4E21F22 |
-132.26 |
7.87 |
-9.04 |
-0.97 |
0 |
|
|
122435 |
50807069 |
1 |
FN2O4H23C29 |
AB2C4D23E29 |
-101.73 |
6.84 |
-8.95 |
-0.81 |
0 |
|
|
122436 |
50807123 |
1 |
BrO3N4C23H25 |
AB3C4D23E25 |
-53.19 |
6.7 |
-8.66 |
-0.94 |
0 |
|
|
122437 |
50807124 |
1 |
ClO3N4C23H25 |
AB3C4D23E25 |
-64.96 |
6.28 |
-8.61 |
-0.86 |
0 |
|
|
122438 |
50807125 |
1 |
ClSN2O3C23H23 |
ABC2D3E23F23 |
-67.74 |
8.51 |
-9.08 |
-1.01 |
0 |
|
|
122439 |
50807126 |
1 |
FSN2O3C23H23 |
ABC2D3E23F23 |
-107.0 |
4.51 |
-8.3 |
-0.69 |
0 |
|
|
122440 |
50807127 |
2 |
NO2H11C12 |
AB2C11D12 |
-89.84 |
8.96 |
-8.7 |
-0.72 |
0 |
|
|
122441 |
50807128 |
1 |
SN2O4H18C21 |
AB2C4D18E21 |
-77.79 |
8.94 |
-8.87 |
-1.09 |
0 |
|
|
122442 |
50807129 |
1 |
N2O5C20H22 |
A2B5C20D22 |
-157.33 |
8.48 |
-8.57 |
-0.68 |
0 |
|
|
122443 |
50807130 |
1 |
N2O5C16H22 |
A2B5C16D22 |
-194.45 |
6.73 |
-8.68 |
-0.69 |
0 |
|
|
122444 |
50807131 |
1 |
ClO3N4C24H27 |
AB3C4D24E27 |
-67.35 |
7.45 |
-8.92 |
-0.87 |
0 |
|
|
122445 |
50807132 |
1 |
ClN3O3C26H32 |
AB3C3D26E32 |
-108.3 |
9.53 |
-8.79 |
-0.89 |
0 |
|
|
122446 |
50807140 |
1 |
N2O4H20C23 |
A2B4C20D23 |
-85.71 |
6.82 |
-8.7 |
-0.56 |
0 |
|
|
122447 |
50807141 |
1 |
N2O4C19H20 |
A2B4C19D20 |
-126.09 |
6.55 |
-8.68 |
-0.51 |
0 |
|
|
122448 |
50807213 |
1 |
SO2N4H14C21 |
AB2C4D14E21 |
29.09 |
2.8 |
-8.56 |
-1.77 |
0 |
|
|
122449 |
50807214 |
1 |
ClSO2N4H15C19 |
ABC2D4E15F19 |
-6.29 |
2.18 |
-8.97 |
-1.67 |
0 |
|
|
122450 |
50807215 |
1 |
SN4O4C22H22 |
AB4C4D22E22 |
-88.55 |
4.36 |
-8.46 |
-1.4 |
0 |
|
|
122451 |
50807221 |
1 |
SO2N4C16H18 |
AB2C4D16E18 |
-51.78 |
2.85 |
-8.8 |
-1.42 |
0 |
|
|
122452 |
50807223 |
1 |
N2O3C18H28 |
A2B3C18D28 |
-148.88 |
6.43 |
-8.9 |
-0.36 |
0 |
|
|
122453 |
50807224 |
1 |
BrN2O3C22H27 |
AB2C3D22E27 |
-105.2 |
5.56 |
-7.96 |
-0.72 |
0 |
|
|
122454 |
50807338 |
1 |
FN3O3C24H28 |
AB3C3D24E28 |
-135.26 |
9.19 |
-8.69 |
-0.76 |
0 |
|
|
122455 |
50807341 |
1 |
ClN2O3C18H19 |
AB2C3D18E19 |
-98.01 |
5.83 |
-8.56 |
-0.88 |
0 |
|
|
122456 |
50807342 |
1 |
FN2O4C24H29 |
AB2C4D24E29 |
-193.47 |
8.02 |
-8.93 |
-0.91 |
0 |
|
|
122457 |
50807462 |
1 |
N2O3C23H30 |
A2B3C23D30 |
-119.17 |
6.96 |
-8.34 |
-0.46 |
0 |
|
|
122458 |
50807493 |
1 |
N2O3C21H24 |
A2B3C21D24 |
-95.41 |
9.48 |
-8.86 |
-0.62 |
0 |
|
|
122459 |
50807510 |
1 |
FON3C30H32 |
ABC3D30E32 |
-18.95 |
6.37 |
-8.2 |
-0.08 |
0 |
|
|
122460 |
50807511 |
1 |
OF2N3H27C28 |
AB2C3D27E28 |
-53.42 |
5.19 |
-8.2 |
-0.34 |
0 |
|
|
122461 |
50807512 |
1 |
FO2N4C28H35 |
AB2C4D28E35 |
-77.17 |
4.73 |
-8.27 |
-0.15 |
0 |