List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
255300 |
103131233 |
1 |
SN3C11H19 |
AB3C11D19 |
26.79 |
5.57 |
-8.17 |
0.63 |
0 |
|
|
255301 |
103131241 |
1 |
SN4C14H16 |
AB4C14D16 |
91.11 |
3.47 |
-8.81 |
-0.62 |
0 |
|
|
255302 |
103131244 |
1 |
FON3C14H18 |
ABC3D14E18 |
-26.96 |
2.52 |
-8.72 |
0.32 |
0 |
|
|
255303 |
103131250 |
1 |
N3F4C13H13 |
A3B4C13D13 |
-138.14 |
3.0 |
-9.33 |
-0.56 |
0 |
|
|
255304 |
103131251 |
1 |
N3F4C14H15 |
A3B4C14D15 |
-146.13 |
3.38 |
-9.14 |
-0.55 |
0 |
|
|
255305 |
103131259 |
1 |
SO2N3C9H15 |
AB2C3D9E15 |
-51.3 |
5.44 |
-9.48 |
0.46 |
0 |
|
|
255306 |
103131267 |
1 |
S2N3C11H19 |
A2B3C11D19 |
32.92 |
1.69 |
-8.6 |
0.61 |
0 |
|
|
255307 |
103131270 |
1 |
S2N3C12H21 |
A2B3C12D21 |
26.44 |
4.35 |
-8.42 |
0.69 |
0 |
|
|
255308 |
103131304 |
4 |
NC3H4 |
AB3C4 |
62.73 |
4.28 |
-9.11 |
0.06 |
0 |
|
|
255309 |
103131308 |
1 |
BrFN3C11H11 |
ABC3D11E11 |
22.94 |
3.62 |
-9.41 |
-0.38 |
0 |
|
|
255310 |
103131309 |
1 |
BrFN3C13H15 |
ABC3D13E15 |
17.55 |
5.46 |
-9.17 |
-0.11 |
0 |
|
|
255311 |
103131310 |
1 |
BrFN3C14H17 |
ABC3D14E17 |
13.07 |
4.98 |
-9.22 |
-0.18 |
0 |
|
|
255312 |
103131315 |
1 |
N4C15H26 |
A4B15C26 |
29.4 |
3.55 |
-8.48 |
0.83 |
0 |
|
|
255313 |
103131316 |
4 |
NC4H7 |
AB4C7 |
24.43 |
3.4 |
-8.5 |
0.84 |
0 |
|
|
255314 |
103131318 |
1 |
ON3C11H19 |
AB3C11D19 |
-10.57 |
4.93 |
-9.02 |
0.67 |
0 |
|
|
255315 |
103131323 |
1 |
N3C12H19 |
A3B12C19 |
34.36 |
2.94 |
-9.0 |
0.84 |
0 |
|
|
255316 |
103131330 |
1 |
ON3C12H23 |
AB3C12D23 |
-24.58 |
4.1 |
-8.75 |
0.76 |
0 |
|
|
255317 |
103131331 |
1 |
ON3C11H19 |
AB3C11D19 |
-21.75 |
2.82 |
-8.84 |
0.87 |
0 |
|
|
255318 |
103131332 |
1 |
ON3C12H21 |
AB3C12D21 |
-22.66 |
3.42 |
-8.97 |
0.72 |
0 |
|
|
255319 |
103131333 |
1 |
ON3C13H23 |
AB3C13D23 |
-28.84 |
3.12 |
-8.88 |
0.74 |
0 |
|
|
255320 |
103131335 |
1 |
BrN4C10H11 |
AB4C10D11 |
78.52 |
3.72 |
-9.37 |
-0.57 |
0 |
|
|
255321 |
103131355 |
1 |
ON3C11H15 |
AB3C11D15 |
26.2 |
2.51 |
-8.9 |
0.62 |
0 |
|
|
255322 |
103131356 |
1 |
ON3C12H17 |
AB3C12D17 |
20.28 |
2.39 |
-8.91 |
0.64 |
0 |
|
|
255323 |
103131373 |
1 |
ON3C12H23 |
AB3C12D23 |
-23.79 |
2.3 |
-8.67 |
1.08 |
0 |
|
|
255324 |
103131378 |
1 |
ON3C13H25 |
AB3C13D25 |
-28.13 |
2.26 |
-8.65 |
1.06 |
0 |
|
|
255325 |
103131384 |
1 |
ON3C13H25 |
AB3C13D25 |
-28.85 |
2.8 |
-8.65 |
0.91 |
0 |
|
|
255326 |
103131386 |
1 |
ON3C10H17 |
AB3C10D17 |
13.62 |
3.9 |
-8.91 |
0.74 |
0 |
|
|
255327 |
103131390 |
1 |
ON3C11H19 |
AB3C11D19 |
6.26 |
4.0 |
-9.16 |
0.79 |
0 |
|
|
255328 |
103131416 |
1 |
ON3C12H21 |
AB3C12D21 |
-23.48 |
4.88 |
-9.15 |
0.67 |
0 |
|
|
255329 |
103131437 |
1 |
ON3C15H27 |
AB3C15D27 |
-26.81 |
2.72 |
-8.8 |
1.02 |
0 |
|
|
255330 |
103131438 |
1 |
ON3C16H29 |
AB3C16D29 |
-38.65 |
2.44 |
-8.44 |
1.13 |
0 |
|
|
255331 |
103131439 |
1 |
ON3C17H31 |
AB3C17D31 |
-42.22 |
2.27 |
-8.75 |
0.98 |
0 |
|
|
255332 |
103131440 |
1 |
ON3C13H23 |
AB3C13D23 |
-25.04 |
1.5 |
-8.85 |
0.96 |
0 |
|
|
255333 |
103131443 |
1 |
ON3C16H29 |
AB3C16D29 |
-39.92 |
2.52 |
-8.45 |
1.12 |
0 |
|
|
255334 |
103131445 |
1 |
ON3C15H27 |
AB3C15D27 |
-41.34 |
3.72 |
-8.78 |
0.71 |
0 |
|
|
255335 |
103131449 |
1 |
ON3C15H27 |
AB3C15D27 |
-33.67 |
3.19 |
-8.76 |
0.89 |
0 |
|
|
255336 |
103131460 |
1 |
ON3C15H27 |
AB3C15D27 |
-28.46 |
3.2 |
-8.68 |
0.89 |
0 |
|
|
255337 |
103131464 |
1 |
ON3C17H31 |
AB3C17D31 |
-38.24 |
3.01 |
-8.68 |
0.89 |
0 |
|
|
255338 |
103131465 |
1 |
ON3C14H19 |
AB3C14D19 |
30.65 |
2.96 |
-8.57 |
0.59 |
0 |
|
|
255339 |
103131484 |
1 |
BrFN3C14H17 |
ABC3D14E17 |
6.39 |
2.46 |
-8.29 |
-0.27 |
0 |
|
|
255340 |
103131490 |
1 |
O2N3C12H23 |
A2B3C12D23 |
-52.38 |
2.71 |
-8.93 |
0.76 |
0 |
|
|
255341 |
103131491 |
1 |
ON5C10H13 |
AB5C10D13 |
40.99 |
4.04 |
-9.38 |
-0.46 |
0 |
|
|
255342 |
103131503 |
1 |
N3C9H13 |
A3B9C13 |
79.13 |
2.84 |
-8.82 |
0.46 |
0 |
|
|
255343 |
103131504 |
1 |
N3C8H11 |
A3B8C11 |
90.7 |
3.35 |
-8.97 |
0.53 |
0 |
|
|
255344 |
103131507 |
1 |
N3C8H11 |
A3B8C11 |
75.38 |
4.62 |
-9.14 |
0.37 |
0 |
|
|
255345 |
103131511 |
1 |
N2O2H10C11 |
A2B2C10D11 |
-17.73 |
5.6 |
-9.41 |
-0.59 |
0 |
|
|
255346 |
103131514 |
1 |
FN2O2H9C11 |
AB2C2D9E11 |
-63.54 |
6.4 |
-9.44 |
-0.84 |
0 |
|
|
255347 |
103131517 |
2 |
NOC6H6 |
ABC6D6 |
-27.45 |
7.33 |
-9.1 |
-0.58 |
0 |
|
|
255348 |
103131521 |
1 |
N2O3C12H12 |
A2B3C12D12 |
-58.02 |
3.82 |
-8.92 |
-0.57 |
0 |
|
|
255349 |
103131524 |
2 |
NOC6H6 |
ABC6D6 |
-26.98 |
8.53 |
-9.26 |
-0.51 |
0 |