List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
260200 |
103184440 |
1 |
N2O2C13H26 |
A2B2C13D26 |
-74.03 |
2.38 |
-8.6 |
2.0 |
0 |
|
|
260201 |
103184468 |
1 |
N2O2C15H30 |
A2B2C15D30 |
-107.35 |
0.92 |
-8.55 |
2.17 |
0 |
|
|
260202 |
103184537 |
1 |
N2O2C15H32 |
A2B2C15D32 |
-111.29 |
2.12 |
-8.45 |
2.19 |
0 |
|
|
260203 |
103184573 |
2 |
NOC8H16 |
ABC8D16 |
-93.7 |
2.34 |
-8.14 |
2.06 |
0 |
|
|
260204 |
103184579 |
1 |
N2O2C17H34 |
A2B2C17D34 |
-92.29 |
2.35 |
-8.58 |
2.01 |
0 |
|
|
260205 |
103184629 |
2 |
NO2C6H11 |
AB2C6D11 |
-186.46 |
3.4 |
-9.63 |
0.45 |
0 |
|
|
260206 |
103184643 |
1 |
N2O4C15H28 |
A2B4C15D28 |
-193.9 |
3.53 |
-9.66 |
0.49 |
0 |
|
|
260207 |
103184751 |
1 |
NO2C10H23 |
AB2C10D23 |
-115.67 |
3.53 |
-8.97 |
2.05 |
0 |
|
|
260208 |
103184752 |
1 |
O2N3C12H19 |
A2B3C12D19 |
-12.15 |
3.31 |
-9.59 |
-1.12 |
0 |
|
|
260209 |
103184813 |
1 |
O2N3C16H21 |
A2B3C16D21 |
12.32 |
3.78 |
-10.0 |
-1.23 |
0 |
|
|
260210 |
103184855 |
1 |
NO2C16H25 |
AB2C16D25 |
-79.75 |
3.06 |
-9.03 |
0.48 |
0 |
|
|
260211 |
103184857 |
1 |
NO2C17H27 |
AB2C17D27 |
-86.15 |
4.16 |
-8.9 |
0.6 |
0 |
|
|
260212 |
103184881 |
1 |
O5C16H22 |
A5B16C22 |
-201.19 |
4.06 |
-9.33 |
-0.38 |
0 |
|
|
260213 |
103184924 |
1 |
O3C12H26 |
A3B12C26 |
-169.6 |
3.6 |
-9.56 |
2.14 |
0 |
|
|
260214 |
103184938 |
1 |
O4C11H22 |
A4B11C22 |
-192.9 |
4.1 |
-9.65 |
1.9 |
0 |
|
|
260215 |
103184939 |
1 |
NO3C11H23 |
AB3C11D23 |
-149.4 |
3.97 |
-9.2 |
1.95 |
0 |
|
|
260216 |
103184959 |
1 |
ClO3C14H21 |
AB3C14D21 |
-136.79 |
5.61 |
-9.32 |
0.11 |
0 |
|
|
260217 |
103184980 |
1 |
ClO2C12H25 |
AB2C12D25 |
-136.85 |
3.17 |
-9.6 |
1.02 |
0 |
|
|
260218 |
103185023 |
1 |
BrO3C11H21 |
AB3C11D21 |
-149.81 |
2.99 |
-9.83 |
-0.23 |
0 |
|
|
260219 |
103185057 |
1 |
ClO2C12H23 |
AB2C12D23 |
-106.95 |
2.01 |
-9.64 |
0.95 |
0 |
|
|
260220 |
103185079 |
2 |
O2C8H13 |
A2B8C13 |
-175.23 |
3.92 |
-9.31 |
0.42 |
0 |
|
|
260221 |
103185156 |
1 |
FNO2C15H22 |
ABC2D15E22 |
-101.83 |
2.71 |
-9.21 |
-0.09 |
0 |
|
|
260222 |
103185157 |
1 |
BrNO2C15H22 |
ABC2D15E22 |
-53.95 |
4.14 |
-9.32 |
-0.18 |
0 |
|
|
260223 |
103185178 |
1 |
INO4C14H18 |
ABC4D14E18 |
-125.25 |
4.28 |
-8.77 |
-0.92 |
0 |
|
|
260224 |
103185229 |
1 |
NSO4C13H21 |
ABC4D13E21 |
-168.27 |
4.53 |
-8.96 |
-0.16 |
0 |
|
|
260225 |
103185351 |
1 |
N3O4C13H19 |
A3B4C13D19 |
-91.35 |
5.71 |
-10.0 |
-1.26 |
0 |
|
|
260226 |
103185367 |
1 |
O2N4C13H20 |
A2B4C13D20 |
13.13 |
3.26 |
-9.05 |
-1.09 |
0 |
|
|
260227 |
103185379 |
1 |
SN2O4C13H18 |
AB2C4D13E18 |
-88.56 |
3.58 |
-9.07 |
-1.28 |
0 |
|
|
260228 |
103185380 |
1 |
N2S2O4H12C13 |
A2B2C4D12E13 |
-39.76 |
5.81 |
-8.98 |
-1.44 |
0 |
|
|
260229 |
103185398 |
1 |
ClO2N3C15H16 |
AB2C3D15E16 |
20.16 |
3.81 |
-8.55 |
-1.44 |
0 |
|
|
260230 |
103185416 |
1 |
O2N3C13H21 |
A2B3C13D21 |
-9.3 |
3.67 |
-9.35 |
-1.14 |
0 |
|
|
260231 |
103185420 |
1 |
ClO2N3C15H16 |
AB2C3D15E16 |
19.93 |
2.74 |
-8.73 |
-1.36 |
0 |
|
|
260232 |
103185423 |
1 |
O2N4C15H26 |
A2B4C15D26 |
-3.22 |
4.13 |
-8.65 |
-1.11 |
0 |
|
|
260233 |
103185469 |
1 |
O2N3C16H19 |
A2B3C16D19 |
23.25 |
2.68 |
-8.52 |
-1.24 |
0 |
|
|
260234 |
103185493 |
1 |
ClO2N3C15H16 |
AB2C3D15E16 |
19.76 |
3.51 |
-8.53 |
-1.27 |
0 |
|
|
260235 |
103185577 |
1 |
O2N5C13H17 |
A2B5C13D17 |
48.59 |
4.54 |
-9.42 |
-1.34 |
0 |
|
|
260236 |
103185681 |
1 |
N3O3C14H21 |
A3B3C14D21 |
-41.79 |
4.23 |
-9.38 |
-1.13 |
0 |
|
|
260237 |
103185715 |
1 |
O2N3C16H25 |
A2B3C16D25 |
-19.11 |
3.39 |
-9.15 |
-1.07 |
0 |
|
|
260238 |
103185920 |
1 |
O2N3C12H17 |
A2B3C12D17 |
17.61 |
0.97 |
-9.29 |
-1.23 |
0 |
|
|
260239 |
103186118 |
1 |
N2O3C13H18 |
A2B3C13D18 |
-50.19 |
3.91 |
-9.96 |
-1.27 |
0 |
|
|
260240 |
103186123 |
1 |
N2O3C15H20 |
A2B3C15D20 |
-49.87 |
4.18 |
-9.88 |
-1.17 |
0 |
|
|
260241 |
103186171 |
1 |
N3O3C15H25 |
A3B3C15D25 |
-52.01 |
3.21 |
-9.07 |
-1.05 |
0 |
|
|
260242 |
103186198 |
1 |
N3O4C11H15 |
A3B4C11D15 |
-77.0 |
5.35 |
-10.18 |
-1.45 |
0 |
|
|
260243 |
103186216 |
1 |
N3O4C13H19 |
A3B4C13D19 |
-83.02 |
3.97 |
-9.27 |
-1.34 |
0 |
|
|
260244 |
103186238 |
1 |
N3O4C13H17 |
A3B4C13D17 |
-57.74 |
6.09 |
-10.0 |
-1.45 |
0 |
|
|
260245 |
103186280 |
1 |
O2N4C13H20 |
A2B4C13D20 |
3.25 |
1.83 |
-8.86 |
-1.09 |
0 |
|
|
260246 |
103186309 |
1 |
F2O2H12C15 |
A2B2C12D15 |
-140.79 |
2.58 |
-9.55 |
-0.94 |
0 |
|
|
260247 |
103186311 |
1 |
O2N4C11H16 |
A2B4C11D16 |
27.94 |
3.51 |
-9.31 |
-1.11 |
0 |
|
|
260248 |
103186411 |
1 |
N3O3C14H15 |
A3B3C14D15 |
-6.41 |
2.87 |
-9.38 |
-1.31 |
0 |
|
|
260249 |
103186523 |
1 |
FNO2H12C17 |
ABC2D12E17 |
-56.64 |
2.12 |
-9.51 |
-1.11 |
0 |