List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
225136 |
85741928 |
1 |
ON2C14H14 |
AB2C14D14 |
72.37 |
4.91 |
-9.64 |
0.03 |
0 |
|
|
225137 |
85741930 |
1 |
O2S2C5H10 |
A2B2C5D10 |
-89.42 |
5.68 |
-9.06 |
0.08 |
0 |
|
|
225138 |
85741931 |
1 |
N2C13H18 |
A2B13C18 |
63.99 |
5.13 |
-10.27 |
0.37 |
0 |
|
|
225139 |
85741933 |
1 |
INO2C9H12 |
ABC2D9E12 |
-61.55 |
6.12 |
-8.11 |
-0.67 |
0 |
|
|
225140 |
85741937 |
1 |
NCl2C10H15 |
AB2C10D15 |
-26.66 |
2.27 |
-8.74 |
-0.33 |
0 |
|
|
225141 |
85741938 |
1 |
NCl2C11H17 |
AB2C11D17 |
-35.32 |
2.69 |
-8.78 |
0.04 |
0 |
|
|
225142 |
85741939 |
1 |
NCl3C9H12 |
AB3C9D12 |
-31.69 |
4.45 |
-8.9 |
-0.2 |
0 |
|
|
225143 |
85741964 |
1 |
NOC13H21 |
ABC13D21 |
-54.98 |
4.21 |
-9.34 |
0.62 |
0 |
|
|
225144 |
85741972 |
1 |
NOC13H21 |
ABC13D21 |
-56.5 |
3.88 |
-9.31 |
0.65 |
0 |
|
|
225145 |
85741993 |
1 |
ClSO2H9C12 |
ABC2D9E12 |
-49.44 |
5.7 |
-9.45 |
-1.06 |
0 |
|
|
225146 |
85741997 |
1 |
SO8N15C35H61 |
AB8C15D35E61 |
-338.72 |
8.46 |
-9.23 |
-0.25 |
0 |
|
|
225147 |
85742008 |
1 |
N8O10C31H50 |
A8B10C31D50 |
-493.96 |
8.64 |
-9.91 |
-0.1 |
0 |
|
|
225148 |
85742013 |
1 |
N3H21C28 |
A3B21C28 |
135.51 |
2.11 |
-8.21 |
-1.03 |
0 |
|
|
225149 |
85742016 |
1 |
O3C16H26 |
A3B16C26 |
-171.91 |
4.51 |
-9.84 |
0.78 |
0 |
|
|
225150 |
85742018 |
1 |
OS2N3C9H13 |
AB2C3D9E13 |
35.49 |
4.99 |
-9.46 |
-0.87 |
0 |
|
|
225151 |
85742021 |
2 |
OC7H8 |
AB7C8 |
-37.54 |
1.19 |
-8.86 |
-0.15 |
0 |
|
|
225152 |
85742024 |
2 |
NOH11C15 |
ABC11D15 |
79.57 |
6.96 |
-8.38 |
-1.33 |
0 |
|
|
225153 |
85742028 |
2 |
ON2H6C13 |
AB2C6D13 |
159.74 |
0.16 |
-9.49 |
-1.7 |
0 |
|
|
225154 |
85742029 |
2 |
N5O5C15H24 |
A5B5C15D24 |
-458.94 |
13.43 |
-9.01 |
-0.1 |
0 |
|
|
225155 |
85747715 |
1 |
N3O5H15C17 |
A3B5C15D17 |
-53.46 |
5.72 |
-9.56 |
-1.46 |
0 |
|
|
225156 |
85747716 |
2 |
NOC7H8 |
ABC7D8 |
-45.41 |
7.51 |
-8.81 |
-0.05 |
0 |
|
|
225157 |
85747742 |
1 |
PO3C11H21 |
AB3C11D21 |
-185.91 |
3.49 |
-9.68 |
0.87 |
0 |
|
|
225158 |
85747746 |
1 |
PO3C11H21 |
AB3C11D21 |
-190.5 |
2.92 |
-9.82 |
0.52 |
0 |
|
|
225159 |
85747748 |
1 |
FN5H12C17 |
AB5C12D17 |
98.69 |
2.86 |
-9.21 |
-1.28 |
0 |
|
|
225160 |
85747749 |
1 |
BrN5H12C17 |
AB5C12D17 |
147.53 |
2.74 |
-9.2 |
-1.27 |
0 |
|
|
225161 |
85747751 |
1 |
NO3C14H17 |
AB3C14D17 |
-119.68 |
5.45 |
-10.01 |
-0.31 |
0 |
|
|
225162 |
85747758 |
1 |
NO4C21H27 |
AB4C21D27 |
-117.6 |
4.47 |
-9.55 |
-1.14 |
0 |
|
|
225163 |
85747759 |
1 |
NO2C20H25 |
AB2C20D25 |
-40.81 |
1.12 |
-9.27 |
-1.06 |
0 |
|
|
225164 |
85747762 |
1 |
O2N3C9H13 |
A2B3C9D13 |
-64.12 |
2.19 |
-7.89 |
0.15 |
0 |
|
|
225165 |
85747764 |
1 |
OSiBr2C13H18 |
ABC2D13E18 |
-61.19 |
2.69 |
-8.97 |
-0.86 |
0 |
|
|
225166 |
85747766 |
1 |
SiBr2O2C15H22 |
AB2C2D15E22 |
-104.14 |
4.08 |
-9.04 |
-0.58 |
0 |
|
|
225167 |
85747778 |
1 |
FO3C9H9 |
AB3C9D9 |
-154.28 |
1.83 |
-10.04 |
-0.53 |
0 |
|
|
225168 |
85747779 |
1 |
ISiO2C10H23 |
ABC2D10E23 |
-159.49 |
1.41 |
-8.6 |
-0.9 |
0 |
|
|
225169 |
85747794 |
1 |
SiO2C19H24 |
AB2C19D24 |
-102.41 |
1.97 |
-9.12 |
0.09 |
0 |
|
|
225170 |
85747795 |
1 |
OSiC13H20 |
ABC13D20 |
-86.52 |
1.13 |
-9.29 |
0.29 |
0 |
|
|
225171 |
85747802 |
1 |
SiO2C20H24 |
AB2C20D24 |
-92.79 |
3.61 |
-9.08 |
0.2 |
0 |
|
|
225172 |
85747805 |
1 |
SiO2C20H26 |
AB2C20D26 |
-111.54 |
1.75 |
-9.2 |
-0.02 |
0 |
|
|
225173 |
85747807 |
1 |
NO3C10H15 |
AB3C10D15 |
-110.84 |
5.2 |
-7.95 |
0.16 |
0 |
|
|
225174 |
85747813 |
1 |
O5C24H36 |
A5B24C36 |
-265.63 |
9.01 |
-10.18 |
-0.14 |
0 |
|
|
225175 |
85747814 |
1 |
O2Si2C25H40 |
A2B2C25D40 |
-179.26 |
0.78 |
-9.24 |
0.15 |
0 |
|
|
225176 |
85747816 |
1 |
O6N8C31H48 |
A6B8C31D48 |
-276.9 |
6.88 |
-8.84 |
-0.38 |
0 |
|
|
225177 |
85747817 |
2 |
OC5H10 |
AB5C10 |
-104.29 |
0.97 |
-9.76 |
1.25 |
0 |
|
|
225178 |
85747819 |
1 |
ClO5C8H17 |
AB5C8D17 |
-262.41 |
8.7 |
-10.35 |
0.12 |
0 |
|
|
225179 |
85747823 |
1 |
FO2C9H13 |
AB2C9D13 |
-146.47 |
1.5 |
-10.55 |
-0.24 |
0 |
|
|
225180 |
85747825 |
2 |
FO2C7H11 |
AB2C7D11 |
-307.86 |
2.15 |
-10.83 |
0.2 |
0 |
|
|
225181 |
85747830 |
1 |
N2O4C29H44 |
A2B4C29D44 |
-184.53 |
7.05 |
-8.67 |
-0.36 |
0 |
|
|
225182 |
85747831 |
1 |
O2N3C17H21 |
A2B3C17D21 |
-33.27 |
1.98 |
-7.95 |
0.07 |
0 |
|
|
225183 |
85747835 |
2 |
NO3C9H11 |
AB3C9D11 |
-184.72 |
4.31 |
-8.79 |
-0.1 |
0 |
|
|
225184 |
85747853 |
1 |
NO2C12H23 |
AB2C12D23 |
-121.61 |
2.58 |
-9.47 |
1.0 |
0 |
|
|
225185 |
85747856 |
1 |
NO3C17H21 |
AB3C17D21 |
-78.37 |
5.35 |
-8.1 |
0.25 |
0 |