List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
391241 |
135003806 |
1 |
ClN2O4C17H19 |
AB2C4D17E19 |
-156.6 |
7.27 |
-9.23 |
-0.24 |
0 |
|
|
391242 |
135003817 |
1 |
N2O5C24H34 |
A2B5C24D34 |
-212.65 |
5.07 |
-8.83 |
-0.19 |
0 |
|
|
391243 |
135003837 |
1 |
BrSF2O3H11C15 |
ABC2D3E11F15 |
-152.38 |
7.52 |
-9.32 |
-0.98 |
0 |
|
|
391244 |
135003847 |
1 |
O4N6H20C23 |
A4B6C20D23 |
10.08 |
11.05 |
-8.85 |
-1.37 |
0 |
|
|
391245 |
135003852 |
1 |
O2N3C24H29 |
A2B3C24D29 |
-51.55 |
2.25 |
-8.88 |
0.05 |
0 |
|
|
391246 |
135003854 |
2 |
NO2C13H15 |
AB2C13D15 |
-122.3 |
4.62 |
-8.05 |
-0.35 |
0 |
|
|
391247 |
135003861 |
1 |
NO3C18H23 |
AB3C18D23 |
-120.47 |
3.09 |
-9.86 |
-0.64 |
0 |
|
|
391248 |
135003862 |
1 |
NSiO2C26H35 |
ABC2D26E35 |
-93.48 |
2.03 |
-8.71 |
-0.05 |
0 |
|
|
391249 |
135003864 |
1 |
N3O5C23H25 |
A3B5C23D25 |
-77.01 |
5.85 |
-9.7 |
-1.56 |
0 |
|
|
391250 |
135003865 |
1 |
ClSN2O2H19C26 |
ABC2D2E19F26 |
35.3 |
5.18 |
-8.65 |
-0.68 |
0 |
|
|
391251 |
135003867 |
1 |
NO6C12H15 |
AB6C12D15 |
-215.53 |
2.79 |
-10.99 |
-0.5 |
0 |
|
|
391252 |
135003893 |
1 |
OS2C25H50 |
AB2C25D50 |
-161.0 |
0.64 |
-8.94 |
-0.42 |
0 |
|
|
391253 |
135003899 |
1 |
O3C16H32 |
A3B16C32 |
-201.69 |
2.51 |
-10.51 |
0.5 |
0 |
|
|
391254 |
135003901 |
2 |
NO2H6C8 |
AB2C6D8 |
-112.48 |
3.01 |
-9.36 |
-1.19 |
0 |
|
|
391255 |
135003908 |
1 |
NWO3C17H23 |
ABC3D17E23 |
119.87 |
3.79 |
-6.46 |
0.28 |
0 |
|
|
391256 |
135003928 |
1 |
NSF6C21H23 |
ABC6D21E23 |
-320.42 |
4.38 |
-8.76 |
-0.61 |
0 |
|
|
391257 |
135003931 |
1 |
ClS3H21C34 |
AB3C21D34 |
201.7 |
3.31 |
-8.23 |
-1.18 |
0 |
|
|
391258 |
135003936 |
1 |
ClOC13H15 |
ABC13D15 |
-8.31 |
1.76 |
-9.15 |
0.28 |
0 |
|
|
391259 |
135003937 |
1 |
NO2S2C15H23 |
AB2C2D15E23 |
-29.37 |
4.74 |
-8.18 |
0.02 |
0 |
|
|
391260 |
135003940 |
1 |
BrOF3H10C12 |
ABC3D10E12 |
-143.12 |
2.9 |
-8.93 |
-1.03 |
0 |
|
|
391261 |
135003964 |
1 |
NPO5C15H24 |
ABC5D15E24 |
-261.01 |
4.0 |
-9.03 |
0.12 |
0 |
|
|
391262 |
135003967 |
1 |
N2O3C17H22 |
A2B3C17D22 |
-132.49 |
2.51 |
-8.54 |
-0.1 |
0 |
|
|
391263 |
135003987 |
1 |
BrNO2C26H26 |
ABC2D26E26 |
-0.52 |
3.55 |
-9.13 |
-0.63 |
0 |
|
|
391264 |
135003994 |
1 |
FN2O2H25C26 |
AB2C2D25E26 |
-39.56 |
4.75 |
-8.39 |
-0.16 |
0 |
|
|
391265 |
135003998 |
1 |
NO5C18H25 |
AB5C18D25 |
-182.54 |
4.98 |
-9.2 |
0.34 |
0 |
|
|
391266 |
135004008 |
1 |
NO4H25C30 |
AB4C25D30 |
-42.21 |
5.85 |
-8.98 |
-0.86 |
0 |
|
|
391267 |
135004014 |
1 |
N3O3C14H23 |
A3B3C14D23 |
-144.57 |
4.06 |
-9.05 |
-0.37 |
0 |
|
|
391268 |
135004025 |
1 |
N2O5C26H38 |
A2B5C26D38 |
-214.38 |
5.35 |
-8.95 |
-0.73 |
0 |
|
|
391269 |
135004026 |
1 |
O4N5H19C23 |
A4B5C19D23 |
20.97 |
2.9 |
-9.53 |
-2.18 |
0 |
|
|
391270 |
135004029 |
1 |
N2O7C29H30 |
A2B7C29D30 |
-235.5 |
2.03 |
-9.28 |
-0.37 |
0 |
|
|
391271 |
135004041 |
1 |
N4O6C25H26 |
A4B6C25D26 |
-102.55 |
7.98 |
-8.74 |
-1.46 |
0 |
|
|
391272 |
135004053 |
1 |
N3O5C25H27 |
A3B5C25D27 |
-132.24 |
3.06 |
-8.59 |
-1.12 |
0 |
|
|
391273 |
135004055 |
1 |
SN2O4C18H20 |
AB2C4D18E20 |
-141.85 |
2.87 |
-8.68 |
-0.4 |
0 |
|
|
391274 |
135004059 |
1 |
ClNO6C16H22 |
ABC6D16E22 |
-260.48 |
5.27 |
-9.41 |
-0.17 |
0 |
|
|
391275 |
135004061 |
2 |
N2O4C11H12 |
A2B4C11D12 |
-233.26 |
4.0 |
-8.73 |
-0.64 |
0 |
|
|
391276 |
135004062 |
1 |
NO5C23H29 |
AB5C23D29 |
-193.61 |
5.9 |
-8.49 |
-0.39 |
0 |
|
|
391277 |
135004064 |
1 |
O2N3C21H25 |
A2B3C21D25 |
-36.88 |
3.43 |
-9.11 |
-0.23 |
0 |
|
|
391278 |
135004080 |
1 |
O4F5Cl7C15H16 |
A4B5C7D15E16 |
-516.99 |
6.6 |
-10.51 |
-0.69 |
0 |
|
|
391279 |
135004081 |
1 |
BrSF2O3H11C15 |
ABC2D3E11F15 |
-152.18 |
8.59 |
-9.42 |
-0.94 |
0 |
|
|
391280 |
135004085 |
1 |
NSiO5C18H27 |
ABC5D18E27 |
-163.37 |
4.14 |
-9.09 |
-0.62 |
0 |
|
|
391281 |
135004086 |
1 |
NO5C19H21 |
AB5C19D21 |
-100.27 |
5.09 |
-9.15 |
-0.71 |
0 |
|
|
391282 |
135004090 |
1 |
NOH17C18 |
ABC17D18 |
4.38 |
1.78 |
-8.56 |
-0.37 |
0 |
|
|
391283 |
135004113 |
1 |
SN2O4H22C25 |
AB2C4D22E25 |
-54.92 |
5.81 |
-9.89 |
-0.55 |
0 |
|
|
391284 |
135004114 |
1 |
NSeO4C16H19 |
ABC4D16E19 |
29.57 |
6.28 |
-9.14 |
-3.03 |
0 |
|
|
391285 |
135004119 |
1 |
FNO2H10C12 |
ABC2D10E12 |
-89.52 |
3.68 |
-10.03 |
-1.44 |
0 |
|
|
391286 |
135004121 |
1 |
N2O5H12C15 |
A2B5C12D15 |
-5.43 |
7.93 |
-9.96 |
-1.91 |
0 |
|
|
391287 |
135004129 |
1 |
BrOH17C18 |
ABC17D18 |
16.42 |
2.76 |
-9.56 |
-0.79 |
0 |
|
|
391288 |
135004153 |
1 |
CrO6C34H40 |
AB6C34D40 |
30.01 |
2.88 |
-6.32 |
0.33 |
0 |
|
|
391289 |
135004154 |
1 |
CrOC29H40 |
ABC29D40 |
24.36 |
0.45 |
-7.35 |
0.51 |
0 |
|
|
391290 |
135004161 |
1 |
CrN2O7C29H30 |
AB2C7D29E30 |
-135.93 |
1.67 |
-8.37 |
-0.15 |
0 |