List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
9064 |
85721 |
1 |
NO3C18H25 |
AB3C18D25 |
-133.2 |
5.01 |
-9.1 |
0.23 |
0 |
|
|
9065 |
85744 |
1 |
SN2O3C8H16 |
AB2C3D8E16 |
-145.78 |
8.47 |
-8.82 |
0.3 |
0 |
|
|
9066 |
85747 |
2 |
OC11H15 |
AB11C15 |
-47.15 |
4.18 |
-8.54 |
1.36 |
0 |
|
|
9067 |
85783 |
1 |
OC11H20 |
AB11C20 |
-86.24 |
3.68 |
-9.8 |
0.77 |
0 |
|
|
9068 |
85805 |
1 |
ClO2C11H11 |
AB2C11D11 |
-79.0 |
4.74 |
-9.79 |
-0.19 |
0 |
|
|
9069 |
85811 |
2 |
OC4H7 |
AB4C7 |
-117.39 |
5.55 |
-10.61 |
0.77 |
0 |
|
|
9070 |
85820 |
2 |
C6H7 |
A6B7 |
22.79 |
0.75 |
-9.22 |
0.48 |
0 |
|
|
9071 |
85821 |
2 |
NC10H14 |
AB10C14 |
11.53 |
2.84 |
-7.71 |
0.32 |
0 |
|
|
9072 |
85822 |
1 |
NSO2C6H11 |
ABC2D6E11 |
-94.66 |
3.75 |
-9.0 |
0.04 |
0 |
|
|
9073 |
85826 |
1 |
O2C13H20 |
A2B13C20 |
-89.92 |
0.8 |
-9.26 |
0.46 |
0 |
|
|
9074 |
85827 |
1 |
NO3C11H11 |
AB3C11D11 |
-85.25 |
3.63 |
-9.82 |
-0.83 |
0 |
|
|
9075 |
85831 |
1 |
O2C13H20 |
A2B13C20 |
-98.66 |
2.89 |
-9.34 |
-0.1 |
0 |
|
|
9076 |
85837 |
1 |
C9H14 |
A9B14 |
11.59 |
0.57 |
-9.54 |
1.28 |
0 |
|
|
9077 |
85839 |
2 |
O2C5H8 |
A2B5C8 |
-178.32 |
4.04 |
-11.3 |
-1.46 |
0 |
|
|
9078 |
85841 |
1 |
BrON2C5H7 |
ABC2D5E7 |
-6.11 |
4.78 |
-10.01 |
-1.29 |
0 |
|
|
9079 |
85844 |
1 |
O3H6C10 |
A3B6C10 |
-37.56 |
2.24 |
-10.54 |
-1.65 |
0 |
|
|
9080 |
85853 |
2 |
O3C11H13 |
A3B11C13 |
-191.61 |
6.77 |
-8.64 |
-0.72 |
0 |
|
|
9081 |
85855 |
2 |
OC5H9 |
AB5C9 |
-111.52 |
5.37 |
-10.3 |
0.37 |
0 |
|
|
9082 |
85878 |
2 |
OC6H9 |
AB6C9 |
-95.56 |
1.24 |
-9.54 |
1.7 |
0 |
|
|
9083 |
85888 |
1 |
PO3C20H27 |
AB3C20D27 |
-142.27 |
2.5 |
-9.02 |
0.13 |
0 |
|
|
9084 |
85892 |
10 |
CH |
AB |
39.71 |
0.69 |
-9.06 |
0.4 |
0 |
|
|
9086 |
85894 |
1 |
CuNO2H11C17 |
ABC2D11E17 |
35.51 |
2.97 |
0.0 |
0.0 |
0 |
|
|
9087 |
85896 |
1 |
ClO2C12H17 |
AB2C12D17 |
-111.65 |
1.63 |
-9.44 |
-0.15 |
0 |
|
|
9089 |
85907 |
2 |
O3C8H13 |
A3B8C13 |
-302.83 |
4.72 |
-10.53 |
0.16 |
0 |
|
|
9090 |
85908 |
2 |
ClON4H14C17 |
ABC4D14E17 |
151.17 |
3.4 |
-8.59 |
-1.52 |
0 |
|
|
9092 |
85932 |
1 |
ON2C9H18 |
AB2C9D18 |
-77.32 |
5.63 |
-9.39 |
1.51 |
0 |
|
|
9093 |
85933 |
2 |
NO3C6H9 |
AB3C6D9 |
-248.13 |
5.95 |
-9.67 |
-1.49 |
0 |
|
|
9094 |
85935 |
1 |
NO3C10H11 |
AB3C10D11 |
-112.97 |
6.39 |
-10.02 |
-0.38 |
0 |
|
|
9095 |
85942 |
2 |
OC7H15 |
AB7C15 |
-158.3 |
2.81 |
-9.88 |
2.69 |
0 |
|
|
9096 |
85950 |
1 |
FNO2C16H20 |
ABC2D16E20 |
-126.21 |
1.98 |
-8.78 |
-0.21 |
0 |
|
|
9097 |
85954 |
1 |
NO2C5H5F6 |
AB2C5D5E6 |
-402.4 |
4.67 |
-10.73 |
-0.35 |
0 |
|
|
9098 |
85958 |
1 |
SO4C7F14 |
AB4C7D14 |
-828.52 |
1.91 |
-11.22 |
-1.96 |
0 |
|
|
9099 |
85982 |
1 |
O4C25H36 |
A4B25C36 |
-131.22 |
4.06 |
-8.15 |
0.28 |
0 |
|
|
9100 |
85998 |
1 |
OC11H20 |
AB11C20 |
-72.46 |
2.39 |
-10.3 |
2.76 |
0 |
|
|
9101 |
86029 |
1 |
O2C17H30 |
A2B17C30 |
-133.35 |
2.69 |
-8.68 |
0.94 |
0 |
|
|
9102 |
86162 |
1 |
NO2H13C15 |
AB2C13D15 |
-15.05 |
3.46 |
-9.05 |
-0.22 |
0 |
|
|
9103 |
86163 |
1 |
NO2H13C17 |
AB2C13D17 |
2.1 |
2.87 |
-8.38 |
-1.17 |
0 |
|
|
9104 |
86168 |
1 |
OSN2C8H8 |
ABC2D8E8 |
9.99 |
5.33 |
-9.12 |
-0.6 |
0 |
|
|
9105 |
86170 |
1 |
OC17H30 |
AB17C30 |
-100.31 |
2.44 |
-10.06 |
2.98 |
0 |
|
|
9106 |
86171 |
1 |
N2O2C23H30 |
A2B2C23D30 |
-34.29 |
2.89 |
-8.41 |
-0.14 |
0 |
|
|
9107 |
86172 |
1 |
S2N3O4C14H21 |
A2B3C4D14E21 |
-156.81 |
7.0 |
-8.57 |
-0.85 |
0 |
|
|
9108 |
86173 |
1 |
Cl2N3O3H17C19 |
A2B3C3D17E19 |
-37.65 |
5.96 |
-9.34 |
-0.74 |
0 |
|
|
9109 |
86174 |
1 |
FIN2O4C9H10 |
ABC2D4E9F10 |
-197.45 |
3.37 |
-9.76 |
-1.62 |
0 |
|
|
9110 |
86189 |
1 |
N6O9C38H58 |
A6B9C38D58 |
-391.44 |
9.69 |
-9.02 |
0.09 |
0 |
|
|
9111 |
86193 |
2 |
O7C16H21 |
A7B16C21 |
-557.93 |
6.47 |
-9.76 |
0.14 |
0 |
|
|
9112 |
86196 |
1 |
NO2C14H19 |
AB2C14D19 |
-42.08 |
2.76 |
-8.79 |
0.02 |
0 |
|
|
9113 |
86198 |
1 |
NO2C14H17 |
AB2C14D17 |
-0.48 |
3.22 |
-8.84 |
-0.07 |
0 |
|
|
9114 |
86204 |
1 |
FCl2N2O3C15H19 |
AB2C2D3E15F19 |
-174.47 |
2.06 |
-9.13 |
-0.84 |
0 |
|
|
9115 |
86208 |
1 |
OC13H16 |
AB13C16 |
-17.23 |
3.01 |
-9.44 |
0.02 |
0 |
|
|
9116 |
86210 |
1 |
ClON3C17H22 |
ABC3D17E22 |
-8.1 |
2.41 |
-9.33 |
-0.08 |
0 |