List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
273200 |
103770673 |
1 |
SN2O2C9H14 |
AB2C2D9E14 |
-68.58 |
2.82 |
-9.99 |
-1.4 |
0 |
|
|
273201 |
103770674 |
1 |
INO2C13H18 |
ABC2D13E18 |
-77.2 |
2.66 |
-9.48 |
-1.0 |
0 |
|
|
273202 |
103770675 |
1 |
BrClNO2C12H15 |
ABCD2E12F15 |
-94.24 |
2.84 |
-9.83 |
-1.13 |
0 |
|
|
273203 |
103770676 |
1 |
ClINO2C12H15 |
ABCD2E12F15 |
-75.43 |
2.54 |
-9.74 |
-1.44 |
0 |
|
|
273204 |
103770677 |
1 |
N2O3C14H18 |
A2B3C14D18 |
-127.22 |
1.01 |
-9.37 |
-0.78 |
0 |
|
|
273205 |
103770679 |
1 |
N2O3C11H16 |
A2B3C11D16 |
-127.93 |
3.13 |
-9.61 |
-1.12 |
0 |
|
|
273206 |
103770682 |
1 |
NO2F4C8H13 |
AB2C4D8E13 |
-309.48 |
4.97 |
-10.45 |
-0.1 |
0 |
|
|
273207 |
103770684 |
1 |
N2O3C15H20 |
A2B3C15D20 |
-138.72 |
0.76 |
-9.27 |
-0.73 |
0 |
|
|
273208 |
103770688 |
1 |
O2N3C10H17 |
A2B3C10D17 |
-67.0 |
5.68 |
-9.56 |
0.02 |
0 |
|
|
273209 |
103770689 |
1 |
BrFNO2C12H15 |
ABCD2E12F15 |
-126.84 |
2.34 |
-10.05 |
-0.96 |
0 |
|
|
273210 |
103770691 |
1 |
BrN2O2C11H15 |
AB2C2D11E15 |
-82.75 |
3.09 |
-9.88 |
-1.25 |
0 |
|
|
273211 |
103770692 |
1 |
NO2C14H23 |
AB2C14D23 |
-85.35 |
3.32 |
-9.75 |
0.84 |
0 |
|
|
273212 |
103770694 |
1 |
NO3C10H21 |
AB3C10D21 |
-167.0 |
2.54 |
-9.82 |
0.84 |
0 |
|
|
273213 |
103770695 |
1 |
NO2C11H21 |
AB2C11D21 |
-118.49 |
3.02 |
-9.8 |
1.09 |
0 |
|
|
273214 |
103770697 |
1 |
BrClNO2C12H15 |
ABCD2E12F15 |
-94.24 |
2.6 |
-9.78 |
-1.1 |
0 |
|
|
273215 |
103770701 |
1 |
NO3C11H17 |
AB3C11D17 |
-119.96 |
2.57 |
-9.77 |
-0.49 |
0 |
|
|
273216 |
103770704 |
1 |
NCl2O3C15H21 |
AB2C3D15E21 |
-153.98 |
2.22 |
-9.36 |
-0.79 |
0 |
|
|
273217 |
103770705 |
2 |
NOC8H11 |
ABC8D11 |
-82.39 |
4.0 |
-8.59 |
-0.1 |
0 |
|
|
273218 |
103770707 |
1 |
INO2C13H18 |
ABC2D13E18 |
-73.46 |
2.78 |
-9.71 |
-1.16 |
0 |
|
|
273219 |
103770708 |
1 |
NO2C14H21 |
AB2C14D21 |
-101.4 |
3.19 |
-9.53 |
-0.02 |
0 |
|
|
273220 |
103770712 |
1 |
NO2C17H21 |
AB2C17D21 |
-73.55 |
2.62 |
-9.2 |
-0.85 |
0 |
|
|
273221 |
103770714 |
1 |
N2O3C16H20 |
A2B3C16D20 |
-121.19 |
3.39 |
-9.3 |
-1.31 |
0 |
|
|
273222 |
103770715 |
2 |
NO2C7H10 |
AB2C7D10 |
-104.45 |
5.19 |
-10.17 |
-1.51 |
0 |
|
|
273223 |
103770716 |
1 |
ClNSO2C15H22 |
ABCD2E15F22 |
-105.04 |
2.55 |
-9.15 |
-0.72 |
0 |
|
|
273224 |
103770717 |
1 |
ClNSO2C15H22 |
ABCD2E15F22 |
-109.36 |
2.18 |
-9.29 |
-0.84 |
0 |
|
|
273225 |
103770718 |
1 |
FNO3C15H22 |
ABC3D15E22 |
-181.26 |
0.63 |
-9.06 |
-0.08 |
0 |
|
|
273226 |
103770719 |
1 |
SN2O4C11H16 |
AB2C4D11E16 |
-88.57 |
2.89 |
-10.22 |
-2.18 |
0 |
|
|
273227 |
103770720 |
1 |
NO3C16H25 |
AB3C16D25 |
-143.68 |
1.77 |
-9.22 |
-0.02 |
0 |
|
|
273228 |
103770726 |
1 |
NSO2C14H21 |
ABC2D14E21 |
-93.12 |
1.98 |
-9.07 |
-0.61 |
0 |
|
|
273229 |
103770730 |
1 |
BrNO3C16H22 |
ABC3D16E22 |
-115.68 |
4.78 |
-9.16 |
-0.81 |
0 |
|
|
273230 |
103770731 |
1 |
ClNSO2C14H20 |
ABCD2E14F20 |
-98.46 |
3.25 |
-8.7 |
-0.5 |
0 |
|
|
273231 |
103770732 |
1 |
NSO2C10H21 |
ABC2D10E21 |
-124.44 |
4.3 |
-8.73 |
0.54 |
0 |
|
|
273232 |
103770734 |
1 |
NO2C12H25 |
AB2C12D25 |
-146.97 |
2.43 |
-9.68 |
1.23 |
0 |
|
|
273233 |
103770738 |
1 |
NSO2C11H17 |
ABC2D11E17 |
-83.14 |
2.59 |
-9.5 |
-0.71 |
0 |
|
|
273234 |
103770739 |
1 |
FNO2C15H22 |
ABC2D15E22 |
-151.92 |
1.19 |
-9.64 |
-0.17 |
0 |
|
|
273235 |
103770740 |
1 |
NO3C17H27 |
AB3C17D27 |
-151.92 |
4.14 |
-8.8 |
0.21 |
0 |
|
|
273236 |
103770741 |
1 |
N2O3C16H24 |
A2B3C16D24 |
-145.22 |
3.55 |
-9.76 |
-0.5 |
0 |
|
|
273237 |
103770743 |
1 |
N2O2C17H22 |
A2B2C17D22 |
-58.74 |
2.62 |
-8.98 |
-0.78 |
0 |
|
|
273238 |
103770744 |
1 |
SN3O3C14H19 |
AB3C3D14E19 |
-109.69 |
1.81 |
-9.39 |
-1.42 |
0 |
|
|
273239 |
103770745 |
1 |
N3O3C10H17 |
A3B3C10D17 |
-135.13 |
1.51 |
-9.29 |
-0.49 |
0 |
|
|
273240 |
103770747 |
1 |
N2O3C12H20 |
A2B3C12D20 |
-114.67 |
5.51 |
-9.84 |
-0.26 |
0 |
|
|
273241 |
103770748 |
1 |
N2O3C14H24 |
A2B3C14D24 |
-124.48 |
4.03 |
-9.81 |
-0.08 |
0 |
|
|
273242 |
103770749 |
1 |
NSO2C15H23 |
ABC2D15E23 |
-106.67 |
4.25 |
-9.24 |
-0.68 |
0 |
|
|
273243 |
103770752 |
1 |
BrFNO2C13H17 |
ABCD2E13F17 |
-134.61 |
1.68 |
-9.95 |
-1.08 |
0 |
|
|
273244 |
103770753 |
1 |
SO2N3C15H21 |
AB2C3D15E21 |
-66.35 |
1.26 |
-8.63 |
-0.42 |
0 |
|
|
273245 |
103770755 |
1 |
ClN2O2C12H17 |
AB2C2D12E17 |
-88.84 |
2.42 |
-9.9 |
-1.16 |
0 |
|
|
273246 |
103770757 |
2 |
NOC8H11 |
ABC8D11 |
-89.24 |
1.63 |
-8.7 |
-0.2 |
0 |
|
|
273247 |
103770758 |
1 |
O2N3C13H23 |
A2B3C13D23 |
-93.54 |
2.81 |
-9.24 |
0.43 |
0 |
|
|
273248 |
103770760 |
1 |
NO3C16H25 |
AB3C16D25 |
-145.66 |
1.29 |
-8.92 |
0.2 |
0 |
|
|
273249 |
103770763 |
1 |
BrNO4C15H22 |
ABC4D15E22 |
-164.11 |
5.17 |
-8.68 |
-0.6 |
0 |