List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
260250 |
103186570 |
1 |
FNO2H12C17 |
ABC2D12E17 |
-56.06 |
5.04 |
-9.42 |
-1.18 |
0 |
|
|
260251 |
103186571 |
1 |
FNO2H10C16 |
ABC2D10E16 |
-54.28 |
4.71 |
-9.59 |
-1.28 |
0 |
|
|
260252 |
103186587 |
1 |
FO3H11C16 |
AB3C11D16 |
-98.46 |
1.0 |
-9.04 |
-1.3 |
0 |
|
|
260253 |
103186665 |
1 |
ClFNSO4H7C12 |
ABCDE4F7G12 |
-155.65 |
0.73 |
-9.9 |
-2.14 |
0 |
|
|
260254 |
103186666 |
1 |
ClFN3O3H9C12 |
ABC3D3E9F12 |
-97.43 |
6.34 |
-10.62 |
-1.88 |
0 |
|
|
260255 |
103186795 |
1 |
ClO2N3C9H12 |
AB2C3D9E12 |
-50.59 |
2.06 |
-9.7 |
-1.54 |
0 |
|
|
260256 |
103186822 |
1 |
ClO2N3C9H12 |
AB2C3D9E12 |
-47.53 |
3.96 |
-9.94 |
-1.55 |
0 |
|
|
260257 |
103186824 |
1 |
ClO2N3C14H14 |
AB2C3D14E14 |
-8.91 |
3.98 |
-9.12 |
-1.44 |
0 |
|
|
260258 |
103186843 |
1 |
ClON3C10H14 |
ABC3D10E14 |
-24.39 |
3.06 |
-10.04 |
-1.44 |
0 |
|
|
260259 |
103186893 |
1 |
ClON4C13H19 |
ABC4D13E19 |
-22.07 |
2.56 |
-8.77 |
-1.46 |
0 |
|
|
260260 |
103186922 |
1 |
ClO2N3C10H12 |
AB2C3D10E12 |
-43.92 |
2.42 |
-9.57 |
-1.5 |
0 |
|
|
260261 |
103186988 |
1 |
ClON3C12H14 |
ABC3D12E14 |
27.35 |
2.84 |
-10.11 |
-1.46 |
0 |
|
|
260262 |
103187021 |
1 |
OCl3N3H12C14 |
AB3C3D12E14 |
3.95 |
4.39 |
-9.64 |
-1.39 |
0 |
|
|
260263 |
103187076 |
1 |
ClN3O3H12C14 |
AB3C3D12E14 |
-46.02 |
3.12 |
-9.0 |
-1.5 |
0 |
|
|
260264 |
103187104 |
1 |
ClO2N3C14H14 |
AB2C3D14E14 |
-22.25 |
4.99 |
-9.08 |
-1.44 |
0 |
|
|
260265 |
103187121 |
1 |
ClO2N4H13C14 |
AB2C4D13E14 |
-21.89 |
2.59 |
-9.35 |
-1.85 |
0 |
|
|
260266 |
103187158 |
1 |
ClO3N4C15H21 |
AB3C4D15E21 |
-112.82 |
3.92 |
-9.78 |
-1.41 |
0 |
|
|
260267 |
103187188 |
1 |
ClO2N3C10H14 |
AB2C3D10E14 |
-45.12 |
5.47 |
-9.66 |
-1.3 |
0 |
|
|
260268 |
103187206 |
1 |
ClO2N3H12C13 |
AB2C3D12E13 |
-27.05 |
1.82 |
-9.33 |
-1.52 |
0 |
|
|
260269 |
103187280 |
1 |
ClOSN3C10H12 |
ABCD3E10F12 |
-11.6 |
3.19 |
-8.87 |
-1.44 |
0 |
|
|
260270 |
103187301 |
1 |
ClO2N3C11H14 |
AB2C3D11E14 |
-66.06 |
2.87 |
-10.05 |
-1.43 |
0 |
|
|
260271 |
103187316 |
1 |
ClO2N3C9H12 |
AB2C3D9E12 |
-26.52 |
3.44 |
-9.93 |
-1.56 |
0 |
|
|
260272 |
103187480 |
1 |
SO2N4C12H22 |
AB2C4D12E22 |
-68.04 |
4.86 |
-8.92 |
-0.32 |
0 |
|
|
260273 |
103187490 |
1 |
SO2N3C15H27 |
AB2C3D15E27 |
-75.75 |
6.22 |
-8.64 |
-0.35 |
0 |
|
|
260274 |
103187512 |
1 |
ClSO2N3C13H22 |
ABC2D3E13F22 |
-77.49 |
6.31 |
-8.46 |
-0.42 |
0 |
|
|
260275 |
103187553 |
4 |
NC4H6 |
AB4C6 |
41.57 |
1.55 |
-7.73 |
-0.48 |
0 |
|
|
260276 |
103187629 |
1 |
N4C13H24 |
A4B13C24 |
13.47 |
2.83 |
-8.22 |
0.16 |
0 |
|
|
260277 |
103187655 |
1 |
ON5C14H27 |
AB5C14D27 |
-24.68 |
1.52 |
-8.14 |
-0.01 |
0 |
|
|
260278 |
103187689 |
1 |
ClN3C14H24 |
AB3C14D24 |
1.74 |
2.64 |
-8.49 |
0.01 |
0 |
|
|
260279 |
103187728 |
1 |
SN3C15H29 |
AB3C15D29 |
6.95 |
3.27 |
-8.58 |
-0.19 |
0 |
|
|
260280 |
103187831 |
1 |
ON3C14H25 |
AB3C14D25 |
-29.58 |
1.84 |
-8.16 |
0.14 |
0 |
|
|
260281 |
103187865 |
1 |
SN3C14H27 |
AB3C14D27 |
14.33 |
1.53 |
-8.54 |
0.06 |
0 |
|
|
260282 |
103187884 |
1 |
ON3C16H29 |
AB3C16D29 |
-30.25 |
4.97 |
-8.51 |
0.38 |
0 |
|
|
260283 |
103187893 |
1 |
N3C16H29 |
A3B16C29 |
4.8 |
1.9 |
-8.41 |
0.26 |
0 |
|
|
260284 |
103187914 |
1 |
N3C11H27 |
A3B11C27 |
-18.99 |
1.33 |
-8.28 |
2.78 |
0 |
|
|
260285 |
103187915 |
1 |
N3C10H25 |
A3B10C25 |
-20.01 |
0.85 |
-8.22 |
2.51 |
0 |
|
|
260286 |
103187955 |
1 |
N2S2O4C13H22 |
A2B2C4D13E22 |
-158.42 |
3.93 |
-8.6 |
-1.47 |
0 |
|
|
260287 |
103188003 |
1 |
N3C15H35 |
A3B15C35 |
-35.89 |
3.92 |
-8.15 |
2.6 |
0 |
|
|
260288 |
103188044 |
1 |
ON3C16H35 |
AB3C16D35 |
-74.14 |
1.87 |
-8.18 |
2.42 |
0 |
|
|
260289 |
103188060 |
1 |
F2N3C15H25 |
A2B3C15D25 |
-73.84 |
4.5 |
-8.44 |
0.04 |
0 |
|
|
260290 |
103188114 |
1 |
O2N3C13H31 |
A2B3C13D31 |
-98.27 |
1.81 |
-8.21 |
1.84 |
0 |
|
|
260291 |
103188144 |
1 |
FN3C17H30 |
AB3C17D30 |
-47.95 |
5.11 |
-8.55 |
0.07 |
0 |
|
|
260292 |
103188146 |
1 |
BrClSN3C13H23 |
ABCD3E13F23 |
17.74 |
4.89 |
-8.56 |
-0.47 |
0 |
|
|
260293 |
103188158 |
1 |
ON3C17H27 |
AB3C17D27 |
2.72 |
2.93 |
-8.51 |
0.01 |
0 |
|
|
260294 |
103188188 |
3 |
FNC5H10 |
ABC5D10 |
-190.26 |
4.66 |
-8.49 |
1.9 |
0 |
|
|
260295 |
103188199 |
1 |
N3C17H35 |
A3B17C35 |
-12.83 |
2.93 |
-8.24 |
2.39 |
0 |
|
|
260296 |
103188207 |
1 |
N3C13H31 |
A3B13C31 |
-25.79 |
3.13 |
-8.39 |
2.58 |
0 |
|
|
260297 |
103188213 |
1 |
N3C17H37 |
A3B17C37 |
-40.62 |
2.53 |
-7.96 |
2.7 |
0 |
|
|
260298 |
103188221 |
1 |
ON3C12H29 |
AB3C12D29 |
-52.33 |
3.8 |
-8.19 |
2.21 |
0 |
|
|
260299 |
103188238 |
3 |
NC6H13 |
AB6C13 |
-47.26 |
2.52 |
-8.29 |
2.44 |
0 |