List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
131307 |
51188509 |
1 |
FSN3O3C16H16 |
ABC3D3E16F16 |
-98.03 |
8.21 |
-9.3 |
-0.82 |
0 |
|
|
131308 |
51188743 |
2 |
NO2C11H19 |
AB2C11D19 |
-224.59 |
3.13 |
-9.37 |
0.72 |
0 |
|
|
131309 |
51188744 |
1 |
ClNO2H12C13 |
ABC2D12E13 |
-40.69 |
5.05 |
-9.26 |
-0.97 |
0 |
|
|
131310 |
51189126 |
1 |
NO2F3C14H16 |
AB2C3D14E16 |
-238.35 |
6.73 |
-9.63 |
-0.7 |
0 |
|
|
131311 |
51189127 |
1 |
ClOSN4H13C14 |
ABCD4E13F14 |
68.53 |
7.03 |
-9.22 |
-0.76 |
0 |
|
|
131312 |
51189128 |
1 |
O3N4C18H18 |
A3B4C18D18 |
-18.91 |
0.89 |
-8.82 |
-0.76 |
0 |
|
|
131313 |
51189129 |
1 |
ON6C20H24 |
AB6C20D24 |
63.5 |
1.56 |
-8.68 |
-0.73 |
0 |
|
|
131314 |
51189130 |
1 |
O2N3C18H27 |
A2B3C18D27 |
-73.54 |
4.27 |
-8.72 |
0.0 |
0 |
|
|
131315 |
51189196 |
1 |
N3O4C21H25 |
A3B4C21D25 |
-168.79 |
8.81 |
-8.12 |
-0.14 |
0 |
|
|
131316 |
51189657 |
2 |
FON2H7C8 |
ABC2D7E8 |
-86.09 |
3.1 |
-9.49 |
-0.84 |
0 |
|
|
131317 |
51189669 |
1 |
NO2C16H23 |
AB2C16D23 |
-101.79 |
4.12 |
-8.97 |
0.24 |
0 |
|
|
131318 |
51189670 |
1 |
NF2O2C14H17 |
AB2C2D14E17 |
-177.63 |
3.44 |
-9.6 |
-0.49 |
0 |
|
|
131319 |
51190142 |
1 |
N2O4C21H22 |
A2B4C21D22 |
-93.36 |
6.17 |
-8.6 |
-0.32 |
0 |
|
|
131320 |
51190586 |
1 |
SN2O4C17H18 |
AB2C4D17E18 |
-39.01 |
7.18 |
-8.97 |
-1.32 |
0 |
|
|
131321 |
51190793 |
1 |
S2N3O3C17H27 |
A2B3C3D17E27 |
-123.87 |
5.83 |
-8.95 |
-0.88 |
0 |
|
|
131322 |
51190794 |
1 |
S2N3O3C15H25 |
A2B3C3D15E25 |
-123.04 |
7.04 |
-9.06 |
-0.91 |
0 |
|
|
131323 |
51190795 |
1 |
S2N3O3C15H25 |
A2B3C3D15E25 |
-130.63 |
4.76 |
-9.24 |
-1.18 |
0 |
|
|
131324 |
51191143 |
1 |
OSN3C15H17 |
ABC3D15E17 |
25.91 |
5.51 |
-8.63 |
-0.37 |
0 |
|
|
131325 |
51191144 |
1 |
OSN3C17H23 |
ABC3D17E23 |
-15.68 |
4.79 |
-8.68 |
-0.39 |
0 |
|
|
131326 |
51191199 |
1 |
NSO4C16H23 |
ABC4D16E23 |
-167.51 |
6.9 |
-9.57 |
-0.46 |
0 |
|
|
131327 |
51191316 |
1 |
ClSN2O2F3H12C14 |
ABC2D2E3F12G14 |
-189.84 |
4.59 |
-10.16 |
-1.41 |
0 |
|
|
131328 |
51191317 |
1 |
BrSN2O3C14H15 |
ABC2D3E14F15 |
-62.69 |
4.71 |
-9.42 |
-0.76 |
0 |
|
|
131329 |
51191318 |
1 |
SF3N3O3C16H16 |
AB3C3D3E16F16 |
-226.83 |
1.9 |
-10.04 |
-1.24 |
0 |
|
|
131330 |
51191319 |
1 |
SN2F3O3H13C14 |
AB2C3D3E13F14 |
-228.65 |
4.69 |
-10.08 |
-0.97 |
0 |
|
|
131331 |
51191320 |
1 |
ClSN2O2C15H15 |
ABC2D2E15F15 |
-21.31 |
2.82 |
-9.67 |
-0.99 |
0 |
|
|
131332 |
51191321 |
1 |
SN2O2C18H24 |
AB2C2D18E24 |
-65.16 |
7.69 |
-9.08 |
-0.3 |
0 |
|
|
131333 |
51191393 |
1 |
ClNO2H12C13 |
ABC2D12E13 |
-34.47 |
2.84 |
-9.66 |
-0.6 |
0 |
|
|
131334 |
51191646 |
1 |
NOF2C17H19 |
ABC2D17E19 |
-141.22 |
3.94 |
-9.15 |
-0.39 |
0 |
|
|
131335 |
51191647 |
1 |
NOSCl2F2H5C11 |
ABCD2E2F5G11 |
-80.77 |
3.54 |
-9.37 |
-1.34 |
0 |
|
|
131336 |
51191648 |
1 |
SF2N2O2H14C15 |
AB2C2D2E14F15 |
-129.57 |
5.19 |
-9.32 |
-0.67 |
0 |
|
|
131337 |
51191650 |
2 |
NO2C9H9 |
AB2C9D9 |
-109.18 |
4.82 |
-8.88 |
-0.73 |
0 |
|
|
131338 |
51192035 |
1 |
OSN4C16H22 |
ABC4D16E22 |
-26.95 |
1.84 |
-8.64 |
-0.73 |
0 |
|
|
131339 |
51192893 |
1 |
SN2O2C19H24 |
AB2C2D19E24 |
-68.48 |
0.77 |
-8.93 |
-0.6 |
0 |
|
|
131340 |
51192943 |
1 |
O3N4C22H30 |
A3B4C22D30 |
-101.23 |
4.65 |
-8.86 |
-0.78 |
0 |
|
|
131341 |
51192944 |
1 |
O2F3N3C18H24 |
A2B3C3D18E24 |
-238.66 |
4.83 |
-9.24 |
-0.93 |
0 |
|
|
131342 |
51193285 |
1 |
O4N5C20H23 |
A4B5C20D23 |
-43.12 |
4.67 |
-8.72 |
-0.72 |
0 |
|
|
131343 |
51193411 |
1 |
SO2N4C18H28 |
AB2C4D18E28 |
-82.95 |
5.25 |
-9.02 |
-0.71 |
0 |
|
|
131344 |
51193412 |
1 |
FN4O4C17H19 |
AB4C4D17E19 |
-179.29 |
2.07 |
-9.87 |
-0.76 |
0 |
|
|
131345 |
51193521 |
1 |
N3O3H15C17 |
A3B3C15D17 |
-43.57 |
2.66 |
-9.16 |
-0.94 |
0 |
|
|
131346 |
51194045 |
1 |
N2O2C17H20 |
A2B2C17D20 |
-23.73 |
2.9 |
-8.72 |
0.06 |
0 |
|
|
131347 |
51194104 |
1 |
N2O3C18H22 |
A2B3C18D22 |
-83.01 |
6.97 |
-9.52 |
-0.59 |
0 |
|
|
131348 |
51194285 |
1 |
BrN3O3C11H14 |
AB3C3D11E14 |
-42.23 |
4.31 |
-9.18 |
-1.37 |
0 |
|
|
131349 |
51194394 |
1 |
N3O5C15H17 |
A3B5C15D17 |
-81.44 |
7.0 |
-9.02 |
-1.22 |
0 |
|
|
131350 |
51194414 |
1 |
SN3O4C13H15 |
AB3C4D13E15 |
-95.26 |
8.8 |
-9.53 |
-1.06 |
0 |
|
|
131351 |
51194415 |
1 |
SN3O3C19H25 |
AB3C3D19E25 |
-91.4 |
10.0 |
-9.38 |
-0.69 |
0 |
|
|
131352 |
51194416 |
1 |
SN4O5C15H16 |
AB4C5D15E16 |
-68.17 |
6.28 |
-9.75 |
-2.14 |
0 |
|
|
131353 |
51194417 |
1 |
S2N3O3C14H17 |
A2B3C3D14E17 |
-70.45 |
6.06 |
-9.11 |
-1.09 |
0 |
|
|
131354 |
51194418 |
1 |
SF3N3O3C16H16 |
AB3C3D3E16F16 |
-225.52 |
7.55 |
-9.57 |
-1.36 |
0 |
|
|
131355 |
51194419 |
1 |
SF3N3O3C16H16 |
AB3C3D3E16F16 |
-227.0 |
6.87 |
-9.66 |
-1.56 |
0 |
|
|
131356 |
51194456 |
1 |
SN3O4C18H21 |
AB3C4D18E21 |
-94.9 |
9.88 |
-9.29 |
-0.85 |
0 |
|
|
131357 |
51194457 |
1 |
SN3O4C18H21 |
AB3C4D18E21 |
-94.89 |
11.71 |
-9.36 |
-0.95 |
0 |
|
|
131358 |
51194691 |
1 |
ClO3N4C17H17 |
AB3C4D17E17 |
-71.44 |
5.72 |
-9.51 |
-1.3 |
0 |
|
|
131359 |
51195177 |
1 |
ClSN2O2H15C17 |
ABC2D2E15F17 |
-46.57 |
2.76 |
-8.92 |
-0.73 |
0 |
|
|
131360 |
51195363 |
1 |
S2N4O5C14H20 |
A2B4C5D14E20 |
-176.58 |
3.39 |
-9.71 |
-1.59 |
0 |
|
|
131361 |
51195560 |
1 |
FO2N3C16H20 |
AB2C3D16E20 |
-82.81 |
3.24 |
-9.01 |
-0.57 |
0 |
|
|
131362 |
51195968 |
1 |
N2O2F3C21H23 |
A2B2C3D21E23 |
-234.3 |
5.36 |
-9.42 |
-0.53 |
0 |
|
|
131363 |
51196450 |
1 |
N3O4C14H19 |
A3B4C14D19 |
-96.76 |
6.21 |
-9.58 |
-1.68 |
0 |
|
|
131364 |
51196814 |
1 |
N2O3C20H24 |
A2B3C20D24 |
-73.46 |
4.61 |
-8.7 |
0.17 |
0 |
|
|
131365 |
51197197 |
1 |
SN3O4C19H29 |
AB3C4D19E29 |
-181.58 |
8.18 |
-9.44 |
-0.43 |
0 |
|
|
131366 |
51197411 |
1 |
SN3O3C14H21 |
AB3C3D14E21 |
-129.59 |
7.42 |
-9.34 |
-1.08 |
0 |
|
|
131367 |
51197462 |
1 |
SN2O2C21H22 |
AB2C2D21E22 |
-23.37 |
3.85 |
-8.85 |
-0.68 |
0 |
|
|
131368 |
51197558 |
1 |
ClO3N5H14C17 |
AB3C5D14E17 |
48.47 |
3.84 |
-9.49 |
-1.91 |
0 |
|
|
131369 |
51197615 |
1 |
O2N5C20H21 |
A2B5C20D21 |
2.09 |
7.71 |
-9.38 |
-0.74 |
0 |
|
|
131370 |
51197616 |
1 |
ClO2N4H17C18 |
AB2C4D17E18 |
8.97 |
4.97 |
-9.33 |
-0.85 |
0 |
|
|
131371 |
51198296 |
1 |
SF2N3O3H15C18 |
AB2C3D3E15F18 |
-157.0 |
1.13 |
-9.36 |
-1.32 |
0 |
|
|
131372 |
51198297 |
1 |
O2N3C20H25 |
A2B3C20D25 |
-61.99 |
2.64 |
-9.0 |
-0.77 |
0 |
|
|
131373 |
51198369 |
1 |
ClFN3O3C17H19 |
ABC3D3E17F19 |
-125.17 |
1.47 |
-9.7 |
-1.08 |
0 |
|
|
131374 |
51198373 |
1 |
O2N5C15H19 |
A2B5C15D19 |
-23.43 |
1.49 |
-9.74 |
-1.39 |
0 |
|
|
131375 |
51198746 |
2 |
N2O2C8H11 |
A2B2C8D11 |
-90.92 |
10.14 |
-8.94 |
-0.86 |
0 |
|
|
131376 |
51198929 |
1 |
OSN5H11C13 |
ABC5D11E13 |
87.8 |
4.6 |
-9.15 |
-1.59 |
0 |
|
|
131377 |
51198930 |
1 |
OSN3C16H21 |
ABC3D16E21 |
8.62 |
6.46 |
-8.84 |
-0.69 |
0 |
|
|
131378 |
51198986 |
1 |
SN3O3C19H19 |
AB3C3D19E19 |
0.97 |
8.99 |
-8.67 |
-0.87 |
0 |
|
|
131379 |
51198987 |
1 |
SO2N4H16C17 |
AB2C4D16E17 |
12.26 |
3.92 |
-8.93 |
-0.72 |
0 |
|
|
131380 |
51198988 |
1 |
ClSO2N3H16C17 |
ABC2D3E16F17 |
6.92 |
4.16 |
-9.22 |
-0.64 |
0 |
|
|
131381 |
51199328 |
1 |
ClON3S3H12C15 |
ABC3D3E12F15 |
56.79 |
1.8 |
-8.95 |
-1.25 |
0 |
|
|
131382 |
51199419 |
1 |
FSO2N4H15C17 |
ABC2D4E15F17 |
-9.14 |
6.19 |
-8.65 |
-0.92 |
0 |
|
|
131383 |
51199420 |
1 |
ClFSN2O3H10C15 |
ABCD2E3F10G15 |
-63.77 |
3.0 |
-8.66 |
-1.15 |
0 |
|
|
131384 |
51199421 |
1 |
FSN2O3C16H17 |
ABC2D3E16F17 |
-121.84 |
2.66 |
-8.47 |
-0.57 |
0 |
|
|
131385 |
51199422 |
1 |
SO2N3H15C20 |
AB2C3D15E20 |
26.92 |
3.31 |
-9.04 |
-1.23 |
0 |
|
|
131386 |
51199423 |
1 |
FO2N3H18C20 |
AB2C3D18E20 |
-51.61 |
2.89 |
-9.11 |
-0.78 |
0 |
|
|
131387 |
51199424 |
1 |
N3O3C18H19 |
A3B3C18D19 |
-62.07 |
3.41 |
-9.0 |
-0.76 |
0 |
|
|
131388 |
51199425 |
1 |
SN2O3C17H22 |
AB2C3D17E22 |
-99.69 |
3.09 |
-8.9 |
-0.95 |
0 |
|
|
131389 |
51199725 |
1 |
SN2O3C20H24 |
AB2C3D20E24 |
-88.85 |
5.97 |
-9.53 |
-0.05 |
0 |
|
|
131390 |
51199726 |
1 |
SO2N3C21H21 |
AB2C3D21E21 |
-16.79 |
1.36 |
-8.99 |
-0.63 |
0 |
|
|
131391 |
51199727 |
1 |
OSN3H19C21 |
ABC3D19E21 |
68.76 |
5.78 |
-9.38 |
-0.89 |
0 |
|
|
131392 |
51199743 |
1 |
OSN2C16H26 |
ABC2D16E26 |
-52.63 |
4.0 |
-8.98 |
-0.17 |
0 |
|
|
131393 |
51199840 |
1 |
O2N3C20H29 |
A2B3C20D29 |
-95.91 |
5.76 |
-9.46 |
0.04 |
0 |
|
|
131394 |
51199841 |
1 |
O2N3C20H23 |
A2B3C20D23 |
-52.27 |
3.48 |
-8.74 |
-0.07 |
0 |
|
|
131395 |
51200293 |
1 |
SN2O3C20H24 |
AB2C3D20E24 |
-105.74 |
2.53 |
-8.49 |
-0.32 |
0 |
|
|
131396 |
51200294 |
1 |
FN4O5H11C18 |
AB4C5D11E18 |
-67.81 |
8.71 |
-9.66 |
-1.71 |
0 |
|
|
131397 |
51200371 |
1 |
FOSN3H18C19 |
ABCD3E18F19 |
-17.22 |
5.21 |
-8.62 |
-1.01 |
0 |
|
|
131398 |
51200428 |
1 |
SF2N2O4H16C17 |
AB2C2D4E16F17 |
-224.02 |
4.17 |
-8.88 |
-0.49 |
0 |
|
|
131399 |
51200698 |
1 |
O3N4C18H18 |
A3B4C18D18 |
-33.29 |
2.6 |
-9.14 |
-0.95 |
0 |
|
|
131400 |
51200720 |
1 |
SO2N3H19C20 |
AB2C3D19E20 |
12.87 |
4.13 |
-9.05 |
-0.98 |
0 |
|
|
131401 |
51200985 |
1 |
ClN2O5C19H23 |
AB2C5D19E23 |
-143.23 |
6.09 |
-8.51 |
-0.71 |
0 |
|
|
131402 |
51201087 |
1 |
N3O4H17C21 |
A3B4C17D21 |
-66.66 |
1.19 |
-9.05 |
-1.32 |
0 |
|
|
131403 |
51201088 |
1 |
NF2O3H17C18 |
AB2C3D17E18 |
-196.61 |
2.05 |
-9.0 |
-0.23 |
0 |
|
|
131404 |
51201089 |
1 |
O2N3H17C18 |
A2B3C17D18 |
-15.42 |
6.09 |
-8.8 |
-0.89 |
0 |
|
|
131405 |
51201208 |
1 |
SN2O4C19H28 |
AB2C4D19E28 |
-153.5 |
4.36 |
-8.7 |
-0.48 |
0 |
|
|
131406 |
51201270 |
1 |
O2N4H16C17 |
A2B4C16D17 |
-11.32 |
9.44 |
-8.87 |
-1.11 |
0 |