List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
272250 |
103736830 |
1 |
N5C11H15 |
A5B11C15 |
80.31 |
7.73 |
-9.07 |
-0.62 |
0 |
|
|
272251 |
103736836 |
1 |
N3C14H17 |
A3B14C17 |
60.43 |
4.57 |
-8.78 |
-0.59 |
0 |
|
|
272252 |
103736926 |
1 |
O2N4C9H14 |
A2B4C9D14 |
-56.38 |
3.7 |
-9.02 |
-0.8 |
0 |
|
|
272253 |
103736927 |
1 |
O2N4C15H26 |
A2B4C15D26 |
-100.34 |
4.86 |
-8.83 |
-0.1 |
0 |
|
|
272254 |
103736952 |
1 |
ON4C12H18 |
AB4C12D18 |
-0.6 |
5.44 |
-8.93 |
-0.54 |
0 |
|
|
272255 |
103736954 |
1 |
SN3C9H15 |
AB3C9D15 |
28.6 |
4.34 |
-8.91 |
-0.32 |
0 |
|
|
272256 |
103736985 |
1 |
FN2O2C12H15 |
AB2C2D12E15 |
-39.06 |
9.43 |
-8.99 |
-1.06 |
0 |
|
|
272257 |
103736986 |
1 |
NSF2O2C13H17 |
ABC2D2E13F17 |
-165.06 |
8.95 |
-8.92 |
-0.24 |
0 |
|
|
272258 |
103736987 |
1 |
ClN3C11H16 |
AB3C11D16 |
12.19 |
4.86 |
-9.18 |
-0.26 |
0 |
|
|
272259 |
103737106 |
1 |
NO3C15H29 |
AB3C15D29 |
-181.13 |
4.72 |
-9.62 |
1.32 |
0 |
|
|
272260 |
103737110 |
2 |
ON2C5H9 |
AB2C5D9 |
-56.9 |
3.58 |
-10.11 |
-0.08 |
0 |
|
|
272261 |
103737130 |
1 |
ClN4O4H9C11 |
AB4C4D9E11 |
-18.27 |
3.84 |
-9.69 |
-1.85 |
0 |
|
|
272262 |
103737182 |
1 |
FIN2O2H10C11 |
ABC2D2E10F11 |
-93.12 |
2.64 |
-9.34 |
-1.45 |
0 |
|
|
272263 |
103737184 |
1 |
ClSO3N4H11C12 |
ABC3D4E11F12 |
8.1 |
3.62 |
-9.6 |
-2.1 |
0 |
|
|
272264 |
103737203 |
1 |
O2N3C11H17 |
A2B3C11D17 |
-59.43 |
2.54 |
-9.83 |
-0.67 |
0 |
|
|
272265 |
103737259 |
1 |
BrFNOC13H15 |
ABCDE13F15 |
-62.44 |
4.06 |
-9.58 |
-0.9 |
0 |
|
|
272266 |
103737270 |
1 |
BrNOC13H16 |
ABCD13E16 |
-16.86 |
3.5 |
-9.5 |
-0.64 |
0 |
|
|
272267 |
103737271 |
1 |
NOC10H19 |
ABC10D19 |
-61.64 |
3.63 |
-9.64 |
1.25 |
0 |
|
|
272268 |
103737291 |
1 |
INOSC11H14 |
ABCDE11F14 |
8.0 |
3.52 |
-9.53 |
-1.27 |
0 |
|
|
272269 |
103737292 |
1 |
ClN2O3C13H15 |
AB2C3D13E15 |
-22.21 |
6.18 |
-10.07 |
-1.53 |
0 |
|
|
272270 |
103737293 |
1 |
NOC11H21 |
ABC11D21 |
-66.58 |
3.54 |
-9.57 |
1.3 |
0 |
|
|
272271 |
103737294 |
1 |
NO3C11H21 |
AB3C11D21 |
-125.86 |
4.17 |
-9.77 |
0.94 |
0 |
|
|
272272 |
103737343 |
1 |
ON2F3C10H17 |
AB2C3D10E17 |
-206.58 |
5.86 |
-9.79 |
0.63 |
0 |
|
|
272273 |
103737362 |
1 |
O2N3C11H17 |
A2B3C11D17 |
-71.15 |
2.6 |
-9.83 |
-0.6 |
0 |
|
|
272274 |
103737363 |
1 |
NO2C10H19 |
AB2C10D19 |
-104.28 |
3.0 |
-9.65 |
1.05 |
0 |
|
|
272275 |
103737364 |
1 |
NOSBr2C11H13 |
ABCD2E11F13 |
-8.88 |
3.76 |
-9.67 |
-1.24 |
0 |
|
|
272276 |
103737400 |
1 |
O2N3C15H17 |
A2B3C15D17 |
-36.71 |
3.05 |
-9.49 |
-1.04 |
0 |
|
|
272277 |
103737468 |
1 |
ClN3O3C12H14 |
AB3C3D12E14 |
-20.6 |
4.24 |
-10.23 |
-1.94 |
0 |
|
|
272278 |
103737507 |
2 |
NO2C7H9 |
AB2C7D9 |
-158.15 |
9.47 |
-9.24 |
-0.5 |
0 |
|
|
272279 |
103737508 |
1 |
NF2O3C15H17 |
AB2C3D15E17 |
-215.38 |
4.2 |
-9.66 |
-0.72 |
0 |
|
|
272280 |
103737509 |
1 |
NO4C12H21 |
AB4C12D21 |
-192.91 |
4.18 |
-9.55 |
0.64 |
0 |
|
|
272281 |
103737542 |
1 |
ClINSO3H11C14 |
ABCDE3F11G14 |
-64.69 |
6.41 |
-9.72 |
-1.63 |
0 |
|
|
272282 |
103737675 |
1 |
N5C10H19 |
A5B10C19 |
33.21 |
1.17 |
-8.58 |
-0.3 |
0 |
|
|
272283 |
103737676 |
1 |
N2F4C13H18 |
A2B4C13D18 |
-196.71 |
6.79 |
-8.81 |
-0.45 |
0 |
|
|
272284 |
103737690 |
1 |
BrON2F4H5C10 |
ABC2D4E5F10 |
-182.57 |
2.11 |
-9.94 |
-1.52 |
0 |
|
|
272285 |
103737724 |
1 |
ClON2C16H25 |
ABC2D16E25 |
-45.31 |
2.87 |
-8.22 |
0.02 |
0 |
|
|
272286 |
103737725 |
1 |
NO3C12H27 |
AB3C12D27 |
-154.91 |
2.69 |
-8.92 |
1.73 |
0 |
|
|
272287 |
103737810 |
1 |
NO2C11H25 |
AB2C11D25 |
-115.94 |
2.95 |
-8.68 |
2.04 |
0 |
|
|
272288 |
103737872 |
1 |
NO3C12H25 |
AB3C12D25 |
-165.45 |
3.48 |
-8.91 |
0.74 |
0 |
|
|
272289 |
103737873 |
1 |
ON2C14H28 |
AB2C14D28 |
-72.38 |
4.07 |
-8.3 |
2.63 |
0 |
|
|
272290 |
103737874 |
1 |
NO2C13H27 |
AB2C13D27 |
-124.44 |
2.06 |
-8.77 |
2.17 |
0 |
|
|
272291 |
103737875 |
1 |
NO3C11H23 |
AB3C11D23 |
-161.43 |
3.16 |
-9.09 |
0.79 |
0 |
|
|
272292 |
103737999 |
1 |
NOC14H29 |
ABC14D29 |
-92.78 |
3.61 |
-8.43 |
2.78 |
0 |
|
|
272293 |
103738000 |
1 |
NOC14H27 |
ABC14D27 |
-83.42 |
3.08 |
-8.62 |
2.67 |
0 |
|
|
272294 |
103738067 |
1 |
ClN2O3C14H17 |
AB2C3D14E17 |
-46.96 |
6.27 |
-9.63 |
-1.39 |
0 |
|
|
272295 |
103738068 |
1 |
OF4N4H6C8 |
AB4C4D6E8 |
-157.86 |
6.32 |
-9.76 |
-0.74 |
0 |
|
|
272296 |
103738069 |
1 |
ClO3N5H8C12 |
AB3C5D8E12 |
59.25 |
5.9 |
-9.39 |
-1.71 |
0 |
|
|
272297 |
103738206 |
1 |
NO2C16H31 |
AB2C16D31 |
-148.81 |
2.55 |
-9.81 |
1.18 |
0 |
|
|
272298 |
103738218 |
1 |
N2O2F3C10H11 |
A2B2C3D10E11 |
-224.99 |
3.94 |
-10.05 |
-0.88 |
0 |
|
|
272299 |
103738221 |
1 |
ClION2C12H16 |
ABCD2E12F16 |
-6.72 |
3.92 |
-8.93 |
-1.29 |
0 |