List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
290300 |
104426520 |
1 |
SN3O4C12H19 |
AB3C4D12E19 |
-144.06 |
7.33 |
-8.72 |
-0.22 |
0 |
|
|
290301 |
104426544 |
1 |
SN2O4C14H22 |
AB2C4D14E22 |
-166.11 |
3.18 |
-8.85 |
-0.3 |
0 |
|
|
290302 |
104426562 |
1 |
SO3N5C10H17 |
AB3C5D10E17 |
-76.75 |
5.81 |
-9.27 |
-0.97 |
0 |
|
|
290303 |
104426564 |
1 |
ClSO3N5C10H16 |
ABC3D5E10F16 |
-91.32 |
6.6 |
-9.46 |
-1.02 |
0 |
|
|
290304 |
104426569 |
1 |
SO3N4C11H18 |
AB3C4D11E18 |
-95.36 |
4.21 |
-9.3 |
-0.78 |
0 |
|
|
290305 |
104426578 |
1 |
SO3N4C12H20 |
AB3C4D12E20 |
-101.66 |
2.34 |
-9.01 |
-0.51 |
0 |
|
|
290306 |
104426597 |
1 |
SN4O4C12H20 |
AB4C4D12E20 |
-128.18 |
3.31 |
-9.34 |
-0.66 |
0 |
|
|
290307 |
104426632 |
1 |
FN3O3C13H18 |
AB3C3D13E18 |
-168.12 |
2.37 |
-8.95 |
-0.5 |
0 |
|
|
290308 |
104426670 |
1 |
OSN4C14H18 |
ABC4D14E18 |
6.21 |
2.64 |
-8.6 |
-0.78 |
0 |
|
|
290309 |
104426976 |
1 |
OF2N4C13H16 |
AB2C4D13E16 |
-107.97 |
6.53 |
-9.05 |
-0.58 |
0 |
|
|
290310 |
104426979 |
1 |
ON5C13H19 |
AB5C13D19 |
-10.62 |
4.82 |
-8.83 |
-0.42 |
0 |
|
|
290311 |
104426984 |
1 |
BrON4C14H19 |
ABC4D14E19 |
-20.84 |
4.99 |
-8.85 |
-0.47 |
0 |
|
|
290312 |
104426990 |
1 |
OF2N4C14H18 |
AB2C4D14E18 |
-112.16 |
6.02 |
-8.97 |
-0.55 |
0 |
|
|
290313 |
104426992 |
1 |
O2N5C14H21 |
A2B5C14D21 |
-54.17 |
4.22 |
-8.47 |
-0.3 |
0 |
|
|
290314 |
104426997 |
1 |
ON4C15H22 |
AB4C15D22 |
-31.49 |
4.5 |
-8.56 |
-0.01 |
0 |
|
|
290315 |
104427000 |
1 |
ON5C14H21 |
AB5C14D21 |
-21.7 |
2.47 |
-8.77 |
-0.28 |
0 |
|
|
290316 |
104427004 |
1 |
BrON4C14H19 |
ABC4D14E19 |
-20.27 |
6.61 |
-8.78 |
-0.47 |
0 |
|
|
290317 |
104427602 |
1 |
N3O4C14H19 |
A3B4C14D19 |
-169.56 |
6.31 |
-9.43 |
-0.96 |
0 |
|
|
290318 |
104427881 |
1 |
N3O4C13H25 |
A3B4C13D25 |
-223.63 |
8.09 |
-10.0 |
0.68 |
0 |
|
|
290319 |
104429018 |
1 |
BrClN2S2O3C10H14 |
ABC2D2E3F10G14 |
-102.19 |
5.42 |
-9.44 |
-1.35 |
0 |
|
|
290320 |
104429112 |
1 |
N3O3C15H23 |
A3B3C15D23 |
-138.53 |
3.79 |
-8.43 |
-0.79 |
0 |
|
|
290321 |
104429260 |
1 |
O2N3C14H23 |
A2B3C14D23 |
-82.45 |
5.68 |
-8.48 |
0.74 |
0 |
|
|
290322 |
104429318 |
1 |
S2N4O5C10H16 |
A2B4C5D10E16 |
-124.39 |
9.6 |
-9.69 |
-1.29 |
0 |
|
|
290323 |
104429333 |
1 |
SO3N4C13H22 |
AB3C4D13E22 |
-121.26 |
7.81 |
-9.2 |
-0.42 |
0 |
|
|
290324 |
104429336 |
1 |
SO3N5C11H19 |
AB3C5D11E19 |
-111.17 |
4.82 |
-9.88 |
-0.96 |
0 |
|
|
290325 |
104429627 |
1 |
O3N4C13H20 |
A3B4C13D20 |
-108.98 |
4.1 |
-8.66 |
-0.44 |
0 |
|
|
290326 |
104429690 |
1 |
O4N5C12H17 |
A4B5C12D17 |
-63.85 |
6.49 |
-9.47 |
-1.63 |
0 |
|
|
290327 |
104429705 |
1 |
O2N6C11H18 |
A2B6C11D18 |
-37.96 |
2.79 |
-9.34 |
-0.91 |
0 |
|
|
290328 |
104429711 |
2 |
ON2C7H11 |
AB2C7D11 |
-79.48 |
3.25 |
-8.97 |
-0.35 |
0 |
|
|
290329 |
104429723 |
1 |
FO2N4C14H21 |
AB2C4D14E21 |
-119.52 |
4.59 |
-8.92 |
-0.68 |
0 |
|
|
290330 |
104429798 |
1 |
ON4C14H20 |
AB4C14D20 |
-27.82 |
6.1 |
-8.09 |
-0.07 |
0 |
|
|
290331 |
104429830 |
1 |
ON3C14H27 |
AB3C14D27 |
-68.31 |
3.63 |
-8.72 |
1.25 |
0 |
|
|
290332 |
104429945 |
1 |
SN4O4C11H18 |
AB4C4D11E18 |
-160.79 |
2.39 |
-9.46 |
-1.15 |
0 |
|
|
290333 |
104429975 |
1 |
ON3C10H21 |
AB3C10D21 |
-65.05 |
2.9 |
-9.38 |
1.11 |
0 |
|
|
290334 |
104430023 |
1 |
O2N3C14H27 |
A2B3C14D27 |
-128.51 |
3.51 |
-9.23 |
1.0 |
0 |
|
|
290335 |
104430053 |
1 |
SN3O3C10H15 |
AB3C3D10E15 |
-119.34 |
7.71 |
-9.29 |
-1.12 |
0 |
|
|
290336 |
104430122 |
1 |
ON4C16H26 |
AB4C16D26 |
-42.65 |
3.26 |
-8.46 |
0.82 |
0 |
|
|
290337 |
104430125 |
1 |
ON4C16H28 |
AB4C16D28 |
-57.51 |
6.29 |
-8.41 |
0.88 |
0 |
|
|
290338 |
104430131 |
1 |
ON4C14H24 |
AB4C14D24 |
-52.06 |
6.12 |
-8.62 |
0.78 |
0 |
|
|
290339 |
104430146 |
1 |
O2N4C15H26 |
A2B4C15D26 |
-84.96 |
6.02 |
-8.64 |
0.68 |
0 |
|
|
290340 |
104430407 |
1 |
O2N5C11H19 |
A2B5C11D19 |
-56.45 |
5.32 |
-8.4 |
0.27 |
0 |
|
|
290341 |
104430416 |
1 |
ClON5C10H16 |
ABC5D10E16 |
-29.76 |
2.93 |
-8.92 |
-0.34 |
0 |
|
|
290342 |
104430614 |
2 |
ON3C6H11 |
AB3C6D11 |
-72.49 |
4.54 |
-9.44 |
0.2 |
0 |
|
|
290343 |
104430920 |
1 |
O2N5C13H23 |
A2B5C13D23 |
-69.04 |
2.69 |
-8.4 |
0.35 |
0 |
|
|
290344 |
104430992 |
1 |
ON6C12H22 |
AB6C12D22 |
-23.89 |
4.54 |
-9.0 |
-0.16 |
0 |
|
|
290345 |
104431181 |
1 |
O2N3C10H19 |
A2B3C10D19 |
-90.57 |
2.28 |
-9.58 |
0.78 |
0 |
|
|
290346 |
104431208 |
1 |
FO2N3C14H18 |
AB2C3D14E18 |
-120.6 |
7.98 |
-9.03 |
-0.3 |
0 |
|
|
290347 |
104431587 |
1 |
O2N4C15H22 |
A2B4C15D22 |
-79.69 |
7.33 |
-8.51 |
0.25 |
0 |
|
|
290348 |
104432031 |
1 |
SN2O2C13H24 |
AB2C2D13E24 |
-105.23 |
4.83 |
-8.53 |
0.74 |
0 |
|
|
290349 |
104432098 |
1 |
N2O3C13H22 |
A2B3C13D22 |
-122.28 |
2.39 |
-8.96 |
0.8 |
0 |
|
|
290350 |
104432293 |
1 |
N3O3C13H27 |
A3B3C13D27 |
-157.62 |
2.74 |
-9.43 |
1.11 |
0 |
|
|
290351 |
104432378 |
1 |
ClON4C14H25 |
ABC4D14E25 |
-45.87 |
4.5 |
-9.0 |
0.47 |
0 |
|
|
290352 |
104432845 |
1 |
N3O3C14H27 |
A3B3C14D27 |
-157.35 |
4.73 |
-9.51 |
0.65 |
0 |
|
|
290353 |
104433049 |
1 |
O2N3C16H31 |
A2B3C16D31 |
-142.39 |
4.0 |
-9.27 |
0.9 |
0 |
|
|
290354 |
104433094 |
1 |
SO3N4C13H20 |
AB3C4D13E20 |
-96.75 |
6.48 |
-9.51 |
-0.91 |
0 |
|
|
290355 |
104433196 |
1 |
N2C17H30 |
A2B17C30 |
-2.08 |
1.46 |
-8.62 |
0.44 |
0 |
|
|
290356 |
104433205 |
1 |
N4C13H26 |
A4B13C26 |
11.52 |
2.89 |
-8.47 |
1.11 |
0 |
|
|
290357 |
104433347 |
1 |
N3C14H25 |
A3B14C25 |
5.8 |
2.91 |
-8.66 |
0.1 |
0 |
|
|
290358 |
104433647 |
2 |
ClNC8H12 |
ABC8D12 |
-15.5 |
4.42 |
-8.69 |
-0.28 |
0 |
|
|
290359 |
104433650 |
1 |
ON2C18H30 |
AB2C18D30 |
-43.45 |
1.1 |
-8.45 |
0.43 |
0 |
|
|
290360 |
104433653 |
2 |
N2C8H15 |
A2B8C15 |
2.74 |
4.12 |
-8.38 |
0.99 |
0 |
|
|
290361 |
104433683 |
1 |
ClN3C14H22 |
AB3C14D22 |
6.29 |
4.24 |
-8.73 |
-0.5 |
0 |
|
|
290362 |
104433823 |
1 |
ClON3C12H20 |
ABC3D12E20 |
-30.84 |
3.03 |
-8.85 |
0.74 |
0 |
|
|
290363 |
104434289 |
1 |
N3O3C13H19 |
A3B3C13D19 |
-113.26 |
8.88 |
-9.14 |
-0.87 |
0 |
|
|
290364 |
104434316 |
1 |
N3O3C13H17 |
A3B3C13D17 |
-102.72 |
11.34 |
-9.17 |
-0.88 |
0 |
|
|
290365 |
104434680 |
1 |
O3N4C14H26 |
A3B4C14D26 |
-135.12 |
4.43 |
-9.01 |
0.83 |
0 |
|
|
290366 |
104434686 |
1 |
OS2N4C9H14 |
AB2C4D9E14 |
4.56 |
8.44 |
-8.56 |
-1.03 |
0 |
|
|
290367 |
104434932 |
1 |
FON4C15H19 |
ABC4D15E19 |
-57.75 |
4.32 |
-8.75 |
-0.37 |
0 |
|
|
290368 |
104435091 |
1 |
ClON5C14H22 |
ABC5D14E22 |
0.01 |
4.05 |
-8.78 |
-0.23 |
0 |
|
|
290369 |
104435112 |
1 |
ClON3C16H20 |
ABC3D16E20 |
-26.36 |
5.19 |
-8.82 |
-0.46 |
0 |
|
|
290370 |
104435221 |
1 |
N3O4C14H25 |
A3B4C14D25 |
-204.58 |
8.65 |
-9.59 |
0.54 |
0 |
|
|
290371 |
104435612 |
1 |
ClN4O4C12H15 |
AB4C4D12E15 |
-72.96 |
3.02 |
-9.68 |
-1.63 |
0 |
|
|
290372 |
104435860 |
1 |
N2O3C15H24 |
A2B3C15D24 |
-143.19 |
2.25 |
-9.13 |
0.67 |
0 |
|
|
290373 |
104436166 |
1 |
SN3O3C12H17 |
AB3C3D12E17 |
-110.27 |
10.27 |
-8.97 |
-0.57 |
0 |
|
|
290374 |
104436749 |
1 |
NSC10H15 |
ABC10D15 |
23.84 |
0.6 |
-9.09 |
-0.24 |
0 |
|
|
290375 |
104437694 |
1 |
N3O4C12H21 |
A3B4C12D21 |
-208.14 |
4.32 |
-9.75 |
-0.31 |
0 |
|
|
290376 |
104437973 |
1 |
BrSN2O2C12H17 |
ABC2D2E12F17 |
-53.43 |
5.52 |
-9.46 |
-0.85 |
0 |
|
|
290377 |
104438357 |
1 |
F2N3H9C15 |
A2B3C9D15 |
22.39 |
6.61 |
-9.07 |
-1.38 |
0 |
|
|
290378 |
104438501 |
1 |
FN2O3C12H15 |
AB2C3D12E15 |
-148.42 |
3.67 |
-9.8 |
-0.82 |
0 |
|
|
290379 |
104438800 |
1 |
SN2O2C12H24 |
AB2C2D12E24 |
-107.34 |
5.09 |
-8.58 |
0.76 |
0 |
|
|
290380 |
104439865 |
1 |
OSN2C11H16 |
ABC2D11E16 |
-20.44 |
3.37 |
-8.97 |
-0.2 |
0 |
|
|
290381 |
104439977 |
1 |
FION2C14H18 |
ABCD2E14F18 |
-62.04 |
4.35 |
-9.04 |
-1.3 |
0 |
|
|
290382 |
104440217 |
2 |
NOC7H13 |
ABC7D13 |
-115.4 |
6.58 |
-9.25 |
1.26 |
0 |
|
|
290383 |
104440315 |
1 |
ClFON2C15H18 |
ABCD2E15F18 |
-85.41 |
6.0 |
-9.43 |
-0.64 |
0 |
|
|
290384 |
104441283 |
1 |
BrON4C9H11 |
ABC4D9E11 |
54.26 |
3.94 |
-8.97 |
-0.54 |
0 |
|
|
290385 |
104441323 |
2 |
ClN2C5H5 |
AB2C5D5 |
63.65 |
3.69 |
-9.27 |
-0.78 |
0 |
|
|
290386 |
104441326 |
4 |
NC4H4 |
AB4C4 |
105.42 |
4.04 |
-8.84 |
-0.41 |
0 |
|
|
290387 |
104441329 |
1 |
BrFN4C10H10 |
ABC4D10E10 |
38.19 |
4.29 |
-9.36 |
-0.79 |
0 |
|
|
290388 |
104441332 |
1 |
ON4C12H16 |
AB4C12D16 |
33.71 |
4.38 |
-8.37 |
-0.13 |
0 |
|
|
290389 |
104442185 |
1 |
ON5C15H23 |
AB5C15D23 |
5.39 |
3.29 |
-7.95 |
0.26 |
0 |
|
|
290390 |
104442258 |
1 |
SO2N6C10H14 |
AB2C6D10E14 |
9.56 |
5.14 |
-9.36 |
-0.71 |
0 |
|
|
290391 |
104443357 |
2 |
ClN2C7H9 |
AB2C7D9 |
52.11 |
4.17 |
-9.52 |
-0.5 |
0 |
|
|
290392 |
104445930 |
1 |
SN7C11H15 |
AB7C11D15 |
108.09 |
7.9 |
-9.06 |
-1.14 |
0 |
|
|
290393 |
104447782 |
1 |
O3N4C14H22 |
A3B4C14D22 |
-107.66 |
6.24 |
-9.72 |
0.06 |
0 |
|
|
290394 |
104448214 |
1 |
O3N5C12H21 |
A3B5C12D21 |
-101.49 |
5.75 |
-10.33 |
-0.02 |
0 |
|
|
290395 |
104449338 |
1 |
ClON7C11H14 |
ABC7D11E14 |
58.48 |
2.17 |
-9.47 |
-1.2 |
0 |
|
|
290396 |
104450646 |
1 |
ClON3C13H18 |
ABC3D13E18 |
-12.09 |
4.11 |
-9.33 |
-0.48 |
0 |
|
|
290397 |
104450841 |
1 |
OSN4C9H12 |
ABC4D9E12 |
43.73 |
5.24 |
-8.68 |
-1.29 |
0 |
|
|
290398 |
104451932 |
1 |
SBr2N2O2H6C11 |
AB2C2D2E6F11 |
-8.87 |
5.92 |
-9.35 |
-1.42 |
0 |
|
|
290399 |
104451944 |
1 |
SBr2O2H5N5C8 |
AB2C2D5E5F8 |
26.66 |
2.87 |
-9.68 |
-1.86 |
0 |