List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
339229 |
127260608 |
1 |
NO2C17H25 |
AB2C17D25 |
-115.17 |
2.19 |
-8.63 |
0.28 |
0 |
|
|
339230 |
127260609 |
1 |
NO3C13H17 |
AB3C13D17 |
-120.65 |
1.91 |
-9.88 |
-0.38 |
0 |
|
|
339231 |
127260610 |
1 |
OC18H28 |
AB18C28 |
-63.64 |
2.31 |
-9.09 |
0.47 |
0 |
|
|
339232 |
127260611 |
1 |
NO2C17H31 |
AB2C17D31 |
-91.89 |
4.38 |
-8.54 |
0.83 |
0 |
|
|
339233 |
127260612 |
1 |
O3C14H24 |
A3B14C24 |
-160.71 |
3.35 |
-10.02 |
0.3 |
0 |
|
|
339234 |
127260613 |
1 |
O3C14H22 |
A3B14C22 |
-105.82 |
4.54 |
-10.2 |
0.2 |
0 |
|
|
339235 |
127260614 |
1 |
O3C13H24 |
A3B13C24 |
-181.09 |
2.06 |
-10.3 |
0.74 |
0 |
|
|
339236 |
127260615 |
1 |
NO4C17H23 |
AB4C17D23 |
-113.45 |
5.2 |
-9.96 |
-1.52 |
0 |
|
|
339237 |
127260616 |
1 |
O5H18C20 |
A5B18C20 |
-156.31 |
2.52 |
-10.05 |
-0.66 |
0 |
|
|
339238 |
127260617 |
1 |
O5H18C20 |
A5B18C20 |
-159.3 |
1.49 |
-10.05 |
-0.64 |
0 |
|
|
339239 |
127260618 |
1 |
O3H22C26 |
A3B22C26 |
-30.29 |
3.56 |
-8.75 |
-0.18 |
0 |
|
|
339240 |
127260619 |
1 |
O7H30C36 |
A7B30C36 |
-141.83 |
4.2 |
-8.83 |
-0.77 |
0 |
|
|
339241 |
127260620 |
1 |
ON2H36C44 |
AB2C36D44 |
142.33 |
3.67 |
-8.05 |
-0.5 |
0 |
|
|
339242 |
127260621 |
1 |
O3C33H44 |
A3B33C44 |
-109.73 |
4.17 |
-8.68 |
-0.31 |
0 |
|
|
339243 |
127260622 |
1 |
O7C28H30 |
A7B28C30 |
-244.73 |
2.55 |
-8.95 |
-0.48 |
0 |
|
|
339244 |
127260623 |
1 |
O3C26H26 |
A3B26C26 |
-39.57 |
4.54 |
-8.89 |
-0.39 |
0 |
|
|
339245 |
127260624 |
1 |
ON2H32C36 |
AB2C32D36 |
118.39 |
3.39 |
-7.96 |
-0.53 |
0 |
|
|
339246 |
127260625 |
2 |
OC7H13 |
AB7C13 |
-138.66 |
3.7 |
-9.28 |
0.76 |
0 |
|
|
339247 |
127260626 |
2 |
OC7H13 |
AB7C13 |
-136.49 |
3.93 |
-9.25 |
0.8 |
0 |
|
|
339248 |
127260627 |
1 |
NOC12H19 |
ABC12D19 |
-50.9 |
2.82 |
-8.31 |
0.53 |
0 |
|
|
339249 |
127260628 |
1 |
OC11H18 |
AB11C18 |
-63.2 |
3.23 |
-9.76 |
0.34 |
0 |
|
|
339250 |
127260629 |
1 |
BrOC10H17 |
ABC10D17 |
-76.08 |
4.99 |
-9.87 |
-0.11 |
0 |
|
|
339251 |
127260630 |
1 |
OC13H18 |
AB13C18 |
-40.65 |
3.29 |
-9.46 |
0.21 |
0 |
|
|
339252 |
127260631 |
1 |
NOSC14H15 |
ABCD14E15 |
-9.47 |
1.99 |
-8.07 |
-0.31 |
0 |
|
|
339253 |
127260632 |
1 |
OC20H22 |
AB20C22 |
-19.11 |
2.85 |
-8.99 |
0.29 |
0 |
|
|
339254 |
127260633 |
1 |
O3C11H18 |
A3B11C18 |
-163.25 |
4.87 |
-9.98 |
0.19 |
0 |
|
|
339255 |
127260634 |
1 |
O3C9H14 |
A3B9C14 |
-149.93 |
4.72 |
-10.02 |
0.13 |
0 |
|
|
339256 |
127260635 |
1 |
O3C9H14 |
A3B9C14 |
-150.18 |
4.57 |
-9.99 |
0.15 |
0 |
|
|
339257 |
127260636 |
1 |
O3C14H16 |
A3B14C16 |
-117.17 |
3.09 |
-9.53 |
0.19 |
0 |
|
|
339258 |
127260637 |
1 |
O3C9H14 |
A3B9C14 |
-150.31 |
3.55 |
-9.91 |
0.46 |
0 |
|
|
339259 |
127260638 |
1 |
O3C9H14 |
A3B9C14 |
-151.32 |
3.7 |
-9.95 |
0.43 |
0 |
|
|
339260 |
127260639 |
1 |
O3C12H20 |
A3B12C20 |
-162.13 |
4.31 |
-9.92 |
0.07 |
0 |
|
|
339261 |
127260640 |
1 |
O3C12H20 |
A3B12C20 |
-164.04 |
3.87 |
-9.91 |
0.15 |
0 |
|
|
339262 |
127260641 |
1 |
O3C9H14 |
A3B9C14 |
-149.58 |
4.18 |
-9.94 |
0.14 |
0 |
|
|
339263 |
127260642 |
1 |
BrOC8H11 |
ABC8D11 |
-39.42 |
3.6 |
-10.04 |
-0.3 |
0 |
|
|
339264 |
127260643 |
1 |
OC10H14 |
AB10C14 |
-26.33 |
3.4 |
-9.76 |
0.13 |
0 |
|
|
339265 |
127260644 |
1 |
OSC13H16 |
ABC13D16 |
-28.03 |
3.53 |
-8.58 |
0.3 |
0 |
|
|
339266 |
127260645 |
1 |
OSC13H16 |
ABC13D16 |
-28.46 |
3.45 |
-8.56 |
0.15 |
0 |
|
|
339267 |
127260646 |
1 |
OC17H26 |
AB17C26 |
-54.54 |
3.29 |
-9.74 |
0.07 |
0 |
|
|
339268 |
127260647 |
1 |
OC15H22 |
AB15C22 |
-50.5 |
3.79 |
-9.5 |
0.25 |
0 |
|
|
339269 |
127260648 |
1 |
OC14H20 |
AB14C20 |
-39.22 |
3.26 |
-9.41 |
0.2 |
0 |
|
|
339270 |
127260649 |
1 |
NOSC17H19 |
ABCD17E19 |
-6.11 |
1.32 |
-7.86 |
-0.44 |
0 |
|
|
339271 |
127260650 |
1 |
OC15H22 |
AB15C22 |
-53.88 |
3.56 |
-9.12 |
0.21 |
0 |
|
|
339272 |
127260651 |
1 |
OC14H20 |
AB14C20 |
-50.29 |
3.14 |
-9.14 |
0.28 |
0 |
|
|
339273 |
127260652 |
1 |
O2H18C19 |
A2B18C19 |
-11.98 |
4.26 |
-8.76 |
-0.7 |
0 |
|
|
339274 |
127260653 |
1 |
OC14H20 |
AB14C20 |
-45.61 |
2.93 |
-9.46 |
0.26 |
0 |
|
|
339275 |
127260654 |
1 |
NO2C16H21 |
AB2C16D21 |
-74.01 |
7.0 |
-8.52 |
-0.24 |
0 |
|
|
339276 |
127260655 |
1 |
NS2O5C13H15 |
AB2C5D13E15 |
-117.52 |
8.9 |
-8.89 |
-1.02 |
0 |
|
|
339277 |
127260656 |
1 |
NO2C15H19 |
AB2C15D19 |
-41.17 |
2.54 |
-9.41 |
-0.1 |
0 |
|
|
339278 |
127260657 |
1 |
O2C11H18 |
A2B11C18 |
-104.2 |
4.22 |
-9.64 |
-0.05 |
0 |