List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
330106 |
127247093 |
1 |
O2N4C15H22 |
A2B4C15D22 |
-67.87 |
4.11 |
-9.42 |
0.25 |
0 |
|
|
330107 |
127247094 |
1 |
SO2N3C14H17 |
AB2C3D14E17 |
-26.07 |
3.6 |
-9.74 |
-0.55 |
0 |
|
|
330108 |
127247095 |
1 |
ON4H16C17 |
AB4C16D17 |
50.14 |
2.97 |
-9.63 |
-1.09 |
0 |
|
|
330109 |
127247096 |
1 |
ON4H16C17 |
AB4C16D17 |
49.3 |
2.47 |
-9.47 |
-1.16 |
0 |
|
|
330110 |
127247097 |
1 |
ClO2N4C13H15 |
AB2C4D13E15 |
3.87 |
3.15 |
-9.83 |
-0.44 |
0 |
|
|
330111 |
127247098 |
1 |
O2N3C17H17 |
A2B3C17D17 |
-0.96 |
4.83 |
-9.26 |
-0.85 |
0 |
|
|
330112 |
127247099 |
1 |
O2N3C17H17 |
A2B3C17D17 |
-5.46 |
4.28 |
-9.17 |
-0.44 |
0 |
|
|
330113 |
127247100 |
1 |
ON5C16H17 |
AB5C16D17 |
45.49 |
7.42 |
-9.23 |
-0.92 |
0 |
|
|
330114 |
127247101 |
2 |
N3C8H10 |
A3B8C10 |
92.13 |
7.46 |
-8.82 |
-0.78 |
0 |
|
|
330115 |
127247102 |
1 |
FN4C17H19 |
AB4C17D19 |
18.93 |
3.96 |
-8.49 |
-0.25 |
0 |
|
|
330116 |
127247103 |
2 |
N3C8H11 |
A3B8C11 |
72.38 |
5.34 |
-8.71 |
0.01 |
0 |
|
|
330117 |
127247104 |
1 |
N3O3C16H17 |
A3B3C16D17 |
-51.94 |
5.53 |
-9.0 |
-0.29 |
0 |
|
|
330118 |
127247105 |
1 |
O2N3C17H21 |
A2B3C17D21 |
-36.5 |
3.96 |
-8.69 |
0.11 |
0 |
|
|
330119 |
127247106 |
1 |
N3O3C16H19 |
A3B3C16D19 |
-59.67 |
4.96 |
-9.32 |
-0.22 |
0 |
|
|
330120 |
127247107 |
1 |
ON5C16H23 |
AB5C16D23 |
7.53 |
4.28 |
-8.93 |
0.4 |
0 |
|
|
330121 |
127247108 |
1 |
OSN3C16H19 |
ABC3D16E19 |
5.41 |
5.0 |
-9.19 |
-0.64 |
0 |
|
|
330122 |
127247109 |
1 |
FO2N3C16H18 |
AB2C3D16E18 |
-69.46 |
2.95 |
-9.0 |
-0.22 |
0 |
|
|
330123 |
127247110 |
1 |
O2N5C15H21 |
A2B5C15D21 |
-5.87 |
5.03 |
-9.8 |
-0.28 |
0 |
|
|
330124 |
127247111 |
1 |
O3N5C14H19 |
A3B5C14D19 |
-99.1 |
4.86 |
-9.64 |
-0.25 |
0 |
|
|
330125 |
127247112 |
1 |
ON3C19H19 |
AB3C19D19 |
28.77 |
2.64 |
-9.04 |
-0.63 |
0 |
|
|
330126 |
127247113 |
1 |
N5C18H19 |
A5B18C19 |
107.14 |
2.45 |
-9.3 |
-0.83 |
0 |
|
|
330127 |
127247114 |
1 |
ClFON3C15H15 |
ABCD3E15F15 |
-42.12 |
4.77 |
-9.65 |
-0.8 |
0 |
|
|
330128 |
127247115 |
1 |
ClFON3C15H15 |
ABCD3E15F15 |
-42.65 |
3.97 |
-9.74 |
-0.64 |
0 |
|
|
330129 |
127247116 |
1 |
ON6C16H16 |
AB6C16D16 |
76.47 |
6.54 |
-9.48 |
-0.57 |
0 |
|
|
330130 |
127247117 |
1 |
ON6C16H16 |
AB6C16D16 |
81.01 |
6.9 |
-9.99 |
-1.21 |
0 |
|
|
330131 |
127247118 |
1 |
ON4C18H20 |
AB4C18D20 |
26.05 |
4.9 |
-8.62 |
-0.14 |
0 |
|
|
330132 |
127247119 |
1 |
O2N5H15C16 |
A2B5C15D16 |
12.61 |
1.93 |
-9.65 |
-1.16 |
0 |
|
|
330133 |
127247120 |
1 |
O2N3C18H19 |
A2B3C18D19 |
-13.3 |
1.95 |
-9.01 |
-0.31 |
0 |
|
|
330134 |
127247121 |
1 |
ON5C17H19 |
AB5C17D19 |
50.66 |
3.09 |
-8.78 |
-0.24 |
0 |
|
|
330135 |
127247122 |
1 |
ON5C17H19 |
AB5C17D19 |
42.12 |
5.83 |
-9.07 |
-0.27 |
0 |
|
|
330136 |
127247123 |
1 |
ON5C17H19 |
AB5C17D19 |
33.69 |
2.04 |
-9.04 |
-0.22 |
0 |
|
|
330137 |
127247124 |
1 |
ON5C17H19 |
AB5C17D19 |
35.25 |
1.49 |
-8.86 |
-0.48 |
0 |
|
|
330138 |
127247125 |
1 |
SO2N5C13H19 |
AB2C5D13E19 |
-19.72 |
5.73 |
-9.51 |
0.1 |
0 |
|
|
330139 |
127247126 |
1 |
ON4C18H22 |
AB4C18D22 |
14.57 |
6.2 |
-8.44 |
-0.19 |
0 |
|
|
330140 |
127247127 |
1 |
O2N3C18H21 |
A2B3C18D21 |
-6.48 |
4.98 |
-8.98 |
-0.05 |
0 |
|
|
330141 |
127247128 |
1 |
O2N3C12H19 |
A2B3C12D19 |
-63.73 |
4.21 |
-9.32 |
0.51 |
0 |
|
|
330142 |
127247129 |
2 |
N2C7H10 |
A2B7C10 |
51.69 |
3.17 |
-8.59 |
0.73 |
0 |
|
|
330143 |
127247130 |
1 |
ON4C13H18 |
AB4C13D18 |
40.36 |
1.33 |
-9.16 |
0.1 |
0 |
|
|
330144 |
127247131 |
1 |
SN4C12H16 |
AB4C12D16 |
67.3 |
2.64 |
-9.14 |
-0.53 |
0 |
|
|
330145 |
127247132 |
1 |
N4C15H20 |
A4B15C20 |
50.11 |
4.84 |
-9.06 |
-0.24 |
0 |
|
|
330146 |
127247133 |
1 |
ON5C14H19 |
AB5C14D19 |
15.49 |
5.51 |
-9.43 |
0.4 |
0 |
|
|
330147 |
127247134 |
1 |
N5C15H23 |
A5B15C23 |
54.67 |
3.51 |
-9.22 |
0.65 |
0 |
|
|
330148 |
127247135 |
1 |
OSN3C14H17 |
ABC3D14E17 |
10.22 |
4.0 |
-9.22 |
-0.44 |
0 |
|
|
330149 |
127247136 |
2 |
ON2C7H10 |
AB2C7D10 |
-66.43 |
2.61 |
-9.11 |
0.25 |
0 |
|
|
330150 |
127247137 |
1 |
ON4C15H24 |
AB4C15D24 |
-27.35 |
4.08 |
-9.17 |
0.74 |
0 |
|
|
330151 |
127247138 |
1 |
N4C17H20 |
A4B17C20 |
69.18 |
3.03 |
-8.46 |
0.0 |
0 |
|
|
330152 |
127247139 |
1 |
ON3C17H21 |
AB3C17D21 |
-2.69 |
6.69 |
-9.1 |
-0.41 |
0 |
|
|
330153 |
127247140 |
1 |
ON4C16H20 |
AB4C16D20 |
9.37 |
3.26 |
-9.45 |
-0.22 |
0 |
|
|
330154 |
127247141 |
1 |
ON5C15H21 |
AB5C15D21 |
17.45 |
5.47 |
-9.51 |
0.38 |
0 |
|
|
330155 |
127247142 |
1 |
FON3C16H20 |
ABC3D16E20 |
-36.62 |
3.63 |
-9.0 |
-0.03 |
0 |
|
|
330156 |
127247143 |
1 |
OSN3C15H19 |
ABC3D15E19 |
-1.33 |
5.05 |
-9.33 |
-0.23 |
0 |
|
|
330157 |
127247144 |
2 |
N2C9H10 |
A2B9C10 |
79.12 |
3.87 |
-8.92 |
-0.75 |
0 |
|
|
330158 |
127247145 |
2 |
N2C9H10 |
A2B9C10 |
79.0 |
2.99 |
-9.14 |
-0.69 |
0 |
|
|
330159 |
127247146 |
1 |
ON5C16H17 |
AB5C16D17 |
50.67 |
3.62 |
-9.11 |
-0.65 |
0 |
|
|
330160 |
127247147 |
1 |
ON3C18H21 |
AB3C18D21 |
26.53 |
2.77 |
-9.46 |
0.04 |
0 |
|
|
330161 |
127247148 |
1 |
ON6C15H16 |
AB6C15D16 |
70.62 |
7.32 |
-9.3 |
-1.34 |
0 |
|
|
330162 |
127247149 |
1 |
ON5C16H19 |
AB5C16D19 |
47.22 |
3.04 |
-9.54 |
-1.02 |
0 |
|
|
330163 |
127247150 |
1 |
N3O3C16H17 |
A3B3C16D17 |
-50.97 |
4.64 |
-9.15 |
-0.53 |
0 |
|
|
330164 |
127247151 |
1 |
ON5C16H21 |
AB5C16D21 |
14.5 |
3.5 |
-9.53 |
-1.02 |
0 |
|
|
330165 |
127247152 |
2 |
ON2C8H10 |
AB2C8D10 |
-30.12 |
3.99 |
-9.31 |
-0.59 |
0 |
|
|
330166 |
127247153 |
1 |
O2N5C15H19 |
A2B5C15D19 |
-15.52 |
5.18 |
-9.3 |
-0.78 |
0 |
|
|
330167 |
127247154 |
1 |
O2N3C17H23 |
A2B3C17D23 |
-30.26 |
6.63 |
-8.57 |
0.32 |
0 |
|
|
330168 |
127247155 |
1 |
ON5C16H23 |
AB5C16D23 |
6.63 |
4.87 |
-9.23 |
0.12 |
0 |
|
|
330169 |
127247156 |
1 |
ON5C16H23 |
AB5C16D23 |
1.96 |
4.91 |
-9.09 |
0.28 |
0 |
|
|
330170 |
127247157 |
1 |
ON5C16H23 |
AB5C16D23 |
7.64 |
0.96 |
-9.16 |
0.59 |
0 |
|
|
330171 |
127247158 |
1 |
N5C17H27 |
A5B17C27 |
44.05 |
6.54 |
-8.89 |
0.75 |
0 |
|
|
330172 |
127247159 |
1 |
O2N5C15H21 |
A2B5C15D21 |
-8.54 |
3.98 |
-9.5 |
-0.3 |
0 |
|
|
330173 |
127247160 |
1 |
OSN3C16H21 |
ABC3D16E21 |
-1.29 |
4.07 |
-9.35 |
-0.46 |
0 |
|
|
330174 |
127247161 |
1 |
O3N4C15H20 |
A3B4C15D20 |
-36.73 |
4.3 |
-9.44 |
0.0 |
0 |
|
|
330175 |
127247162 |
1 |
ON4C17H28 |
AB4C17D28 |
-34.79 |
2.52 |
-8.54 |
0.43 |
0 |
|
|
330176 |
127247163 |
1 |
ON4C18H18 |
AB4C18D18 |
39.53 |
5.31 |
-9.19 |
-1.18 |
0 |
|
|
330177 |
127247164 |
1 |
ON4C18H18 |
AB4C18D18 |
39.23 |
4.59 |
-9.19 |
-1.11 |
0 |
|
|
330178 |
127247165 |
1 |
N5C18H21 |
A5B18C21 |
95.51 |
1.37 |
-9.02 |
-0.25 |
0 |
|
|
330179 |
127247166 |
1 |
ON4C18H20 |
AB4C18D20 |
20.46 |
5.58 |
-8.64 |
-0.16 |
0 |
|
|
330180 |
127247167 |
1 |
FSO2N3C14H16 |
ABC2D3E14F16 |
-69.81 |
2.49 |
-9.37 |
-0.98 |
0 |