List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
286100 |
104152755 |
1 |
N3C17H29 |
A3B17C29 |
-14.44 |
2.62 |
-8.34 |
0.34 |
0 |
|
|
286101 |
104152813 |
1 |
ON3C15H21 |
AB3C15D21 |
-0.48 |
1.62 |
-8.62 |
0.12 |
0 |
|
|
286102 |
104152814 |
1 |
ON3C17H25 |
AB3C17D25 |
-1.94 |
1.23 |
-8.61 |
0.25 |
0 |
|
|
286103 |
104152815 |
1 |
ON3C16H27 |
AB3C16D27 |
-42.45 |
2.57 |
-8.35 |
0.3 |
0 |
|
|
286104 |
104152837 |
3 |
NC6H11 |
AB6C11 |
-30.38 |
1.9 |
-8.26 |
0.46 |
0 |
|
|
286105 |
104152839 |
1 |
N3C16H29 |
A3B16C29 |
-19.87 |
2.59 |
-8.34 |
0.35 |
0 |
|
|
286106 |
104152840 |
1 |
N3C17H31 |
A3B17C31 |
-17.59 |
3.15 |
-8.24 |
0.47 |
0 |
|
|
286107 |
104152841 |
1 |
N3C17H31 |
A3B17C31 |
-25.43 |
2.39 |
-8.29 |
0.38 |
0 |
|
|
286108 |
104152843 |
3 |
NC6H11 |
AB6C11 |
-24.21 |
2.82 |
-8.19 |
0.48 |
0 |
|
|
286109 |
104152845 |
1 |
N3C17H31 |
A3B17C31 |
-19.68 |
1.51 |
-8.14 |
0.56 |
0 |
|
|
286110 |
104152847 |
3 |
NC6H11 |
AB6C11 |
-25.78 |
2.4 |
-8.28 |
0.42 |
0 |
|
|
286111 |
104152848 |
1 |
O2N3C16H29 |
A2B3C16D29 |
-77.69 |
4.31 |
-8.49 |
0.19 |
0 |
|
|
286112 |
104152849 |
1 |
O2N3C16H29 |
A2B3C16D29 |
-82.25 |
4.34 |
-8.42 |
0.27 |
0 |
|
|
286113 |
104152850 |
1 |
O2N3C16H29 |
A2B3C16D29 |
-83.14 |
2.71 |
-8.25 |
0.39 |
0 |
|
|
286114 |
104152854 |
3 |
NC6H11 |
AB6C11 |
-31.84 |
2.18 |
-8.2 |
0.5 |
0 |
|
|
286115 |
104152855 |
1 |
N3C17H31 |
A3B17C31 |
-22.5 |
2.43 |
-8.24 |
0.46 |
0 |
|
|
286116 |
104152856 |
1 |
N3C16H29 |
A3B16C29 |
-21.08 |
2.69 |
-8.29 |
0.35 |
0 |
|
|
286117 |
104152873 |
1 |
ON3C15H27 |
AB3C15D27 |
-37.52 |
2.45 |
-8.47 |
0.31 |
0 |
|
|
286118 |
104152994 |
1 |
SN3C17H29 |
AB3C17D29 |
-4.4 |
3.06 |
-8.41 |
0.29 |
0 |
|
|
286119 |
104153027 |
1 |
ON3C17H29 |
AB3C17D29 |
-44.9 |
2.7 |
-8.3 |
0.42 |
0 |
|
|
286120 |
104153062 |
4 |
NC4H7 |
AB4C7 |
9.02 |
3.19 |
-8.23 |
0.44 |
0 |
|
|
286121 |
104153244 |
1 |
N4C17H28 |
A4B17C28 |
12.01 |
3.98 |
-8.26 |
0.48 |
0 |
|
|
286122 |
104153246 |
1 |
N4C17H28 |
A4B17C28 |
4.63 |
3.46 |
-8.41 |
0.34 |
0 |
|
|
286123 |
104153267 |
1 |
N3C18H29 |
A3B18C29 |
8.15 |
3.28 |
-8.15 |
0.51 |
0 |
|
|
286124 |
104153268 |
1 |
N3C18H31 |
A3B18C31 |
-22.24 |
1.11 |
-8.06 |
0.65 |
0 |
|
|
286125 |
104153269 |
1 |
N3C18H31 |
A3B18C31 |
-20.22 |
0.22 |
-8.06 |
0.59 |
0 |
|
|
286126 |
104153270 |
1 |
N3C16H27 |
A3B16C27 |
-16.7 |
2.79 |
-8.16 |
0.47 |
0 |
|
|
286127 |
104153271 |
1 |
N3C15H25 |
A3B15C25 |
-12.56 |
2.89 |
-8.22 |
0.44 |
0 |
|
|
286128 |
104153272 |
1 |
N3C17H29 |
A3B17C29 |
-14.09 |
1.47 |
-8.07 |
0.63 |
0 |
|
|
286129 |
104153274 |
1 |
N3C16H27 |
A3B16C27 |
-11.32 |
0.88 |
-8.06 |
0.64 |
0 |
|
|
286130 |
104153295 |
1 |
N4C17H28 |
A4B17C28 |
29.88 |
2.38 |
-8.3 |
0.35 |
0 |
|
|
286131 |
104153366 |
1 |
ON3C16H29 |
AB3C16D29 |
-45.56 |
2.21 |
-8.31 |
0.41 |
0 |
|
|
286132 |
104153990 |
1 |
N3C16H25 |
A3B16C25 |
58.01 |
2.06 |
-8.54 |
0.24 |
0 |
|
|
286133 |
104154132 |
1 |
N3C17H29 |
A3B17C29 |
8.93 |
0.93 |
-8.09 |
0.56 |
0 |
|
|
286134 |
104154287 |
1 |
SN3C16H29 |
AB3C16D29 |
-1.55 |
2.54 |
-8.35 |
0.32 |
0 |
|
|
286135 |
104154485 |
1 |
N3C13H21 |
A3B13C21 |
27.79 |
2.36 |
-8.5 |
0.29 |
0 |
|
|
286136 |
104154487 |
1 |
N3C16H27 |
A3B16C27 |
11.71 |
2.17 |
-8.46 |
0.32 |
0 |
|
|
286137 |
104154549 |
1 |
N3C16H29 |
A3B16C29 |
-19.1 |
2.8 |
-8.39 |
0.39 |
0 |
|
|
286138 |
104154565 |
1 |
ON3C15H27 |
AB3C15D27 |
-50.36 |
1.12 |
-8.35 |
0.53 |
0 |
|
|
286139 |
104154603 |
1 |
BrN4C14H19 |
AB4C14D19 |
46.33 |
2.01 |
-8.95 |
-0.55 |
0 |
|
|
286140 |
104154714 |
4 |
NC4H6 |
AB4C6 |
35.65 |
5.91 |
-9.28 |
-0.66 |
0 |
|
|
286141 |
104154807 |
1 |
N4C17H24 |
A4B17C24 |
62.68 |
2.74 |
-8.97 |
-0.57 |
0 |
|
|
286142 |
104155189 |
1 |
ON3C17H29 |
AB3C17D29 |
-47.23 |
1.6 |
-8.63 |
0.19 |
0 |
|
|
286143 |
104155207 |
1 |
N2O2C17H26 |
A2B2C17D26 |
-65.92 |
3.52 |
-9.12 |
0.08 |
0 |
|
|
286144 |
104155244 |
1 |
N2O2C17H22 |
A2B2C17D22 |
-45.64 |
2.25 |
-8.86 |
0.01 |
0 |
|
|
286145 |
104155418 |
1 |
N2O2C17H24 |
A2B2C17D24 |
-46.85 |
2.95 |
-9.05 |
0.08 |
0 |
|
|
286146 |
104155736 |
2 |
NOC8H13 |
ABC8D13 |
-60.54 |
1.55 |
-9.07 |
0.12 |
0 |
|
|
286147 |
104155903 |
1 |
ON2C18H30 |
AB2C18D30 |
-41.6 |
1.82 |
-9.04 |
0.15 |
0 |
|
|
286148 |
104155935 |
1 |
ON2C18H28 |
AB2C18D28 |
-37.47 |
1.74 |
-8.96 |
0.22 |
0 |
|
|
286149 |
104156288 |
1 |
ClON2C16H19 |
ABC2D16E19 |
-5.12 |
2.43 |
-9.11 |
-0.13 |
0 |
|
|
286150 |
104156468 |
1 |
ON3C16H27 |
AB3C16D27 |
-43.1 |
2.84 |
-8.78 |
0.19 |
0 |
|
|
286151 |
104156586 |
1 |
FON2C16H19 |
ABC2D16E19 |
-45.31 |
3.3 |
-9.2 |
-0.23 |
0 |
|
|
286152 |
104156633 |
1 |
BrON2C13H15 |
ABC2D13E15 |
8.38 |
4.51 |
-8.64 |
-0.63 |
0 |
|
|
286153 |
104156666 |
1 |
ION2C15H17 |
ABC2D15E17 |
24.47 |
5.05 |
-9.21 |
-0.85 |
0 |
|
|
286154 |
104156733 |
1 |
N2O2C15H24 |
A2B2C15D24 |
-84.03 |
2.47 |
-9.12 |
0.06 |
0 |
|
|
286155 |
104157115 |
1 |
ON2C18H32 |
AB2C18D32 |
-72.71 |
2.12 |
-8.91 |
0.24 |
0 |
|
|
286156 |
104157362 |
1 |
OF2N2C16H26 |
AB2C2D16E26 |
-163.13 |
4.02 |
-9.16 |
-0.08 |
0 |
|
|
286157 |
104157398 |
1 |
BrON2C16H19 |
ABC2D16E19 |
7.58 |
5.36 |
-9.28 |
-0.24 |
0 |
|
|
286158 |
104157501 |
1 |
ClNO3C15H20 |
ABC3D15E20 |
-129.92 |
2.75 |
-9.87 |
-1.16 |
0 |
|
|
286159 |
104157502 |
1 |
ClNO3C16H22 |
ABC3D16E22 |
-136.0 |
2.58 |
-9.89 |
-1.12 |
0 |
|
|
286160 |
104157503 |
1 |
ClNO3C15H20 |
ABC3D15E20 |
-130.27 |
4.18 |
-9.82 |
-1.2 |
0 |
|
|
286161 |
104157505 |
1 |
ClNO3C15H22 |
ABC3D15E22 |
-134.0 |
3.6 |
-9.92 |
-1.09 |
0 |
|
|
286162 |
104157510 |
1 |
ClNO3C12H14 |
ABC3D12E14 |
-113.78 |
2.16 |
-10.06 |
-1.26 |
0 |
|
|
286163 |
104157511 |
1 |
ClNO2C13H16 |
ABC2D13E16 |
-61.13 |
3.96 |
-9.94 |
-1.07 |
0 |
|
|
286164 |
104157515 |
1 |
ClNO3C14H18 |
ABC3D14E18 |
-126.86 |
2.72 |
-10.0 |
-1.16 |
0 |
|
|
286165 |
104157860 |
1 |
ClON2C17H25 |
ABC2D17E25 |
-38.59 |
3.34 |
-8.36 |
-0.08 |
0 |
|
|
286166 |
104157861 |
1 |
ClON2C16H23 |
ABC2D16E23 |
-35.76 |
3.98 |
-8.65 |
-0.03 |
0 |
|
|
286167 |
104157887 |
1 |
ClFNOH15C16 |
ABCDE15F16 |
-49.47 |
5.54 |
-8.8 |
-0.2 |
0 |
|
|
286168 |
104158127 |
1 |
BrSN2C13H15 |
ABC2D13E15 |
41.11 |
4.39 |
-8.81 |
-0.73 |
0 |
|
|
286169 |
104158133 |
1 |
ClNO2C14H20 |
ABC2D14E20 |
-82.95 |
3.73 |
-8.76 |
-0.14 |
0 |
|
|
286170 |
104158162 |
1 |
F2O2N3H11C12 |
A2B2C3D11E12 |
-74.32 |
5.93 |
-9.43 |
-1.6 |
0 |
|
|
286171 |
104158262 |
1 |
BrN2O2C14H15 |
AB2C2D14E15 |
-37.2 |
5.28 |
-8.84 |
-0.75 |
0 |
|
|
286172 |
104158273 |
1 |
ClNO2C17H24 |
ABC2D17E24 |
-101.01 |
2.11 |
-8.62 |
0.01 |
0 |
|
|
286173 |
104158316 |
1 |
BrON2C16H19 |
ABC2D16E19 |
-11.44 |
4.5 |
-8.64 |
-0.65 |
0 |
|
|
286174 |
104158433 |
1 |
SN2F3O3H11C12 |
AB2C3D3E11F12 |
-174.47 |
7.09 |
-9.39 |
-1.32 |
0 |
|
|
286175 |
104158434 |
1 |
BrN2O2C14H17 |
AB2C2D14E17 |
-37.97 |
4.61 |
-8.78 |
-0.75 |
0 |
|
|
286176 |
104158435 |
1 |
SN2O3C15H20 |
AB2C3D15E20 |
-40.71 |
5.62 |
-8.96 |
-0.87 |
0 |
|
|
286177 |
104158505 |
1 |
ON2C15H20 |
AB2C15D20 |
-15.68 |
4.09 |
-9.21 |
-0.84 |
0 |
|
|
286178 |
104158539 |
1 |
SN2C14H18 |
AB2C14D18 |
40.9 |
4.93 |
-8.77 |
-0.64 |
0 |
|
|
286179 |
104158704 |
1 |
O2N3C15H25 |
A2B3C15D25 |
-77.51 |
6.41 |
-8.88 |
-0.16 |
0 |
|
|
286180 |
104158705 |
1 |
BrO2N3C12H20 |
AB2C3D12E20 |
-72.29 |
7.44 |
-8.9 |
-0.42 |
0 |
|
|
286181 |
104158707 |
1 |
OSN3C10H19 |
ABC3D10E19 |
-23.94 |
4.81 |
-8.85 |
-0.64 |
0 |
|
|
286182 |
104158708 |
1 |
ON4C16H20 |
AB4C16D20 |
35.75 |
10.08 |
-9.03 |
-1.17 |
0 |
|
|
286183 |
104158711 |
1 |
ON4C9H18 |
AB4C9D18 |
-13.87 |
7.41 |
-9.68 |
0.26 |
0 |
|
|
286184 |
104158730 |
1 |
ON2C17H24 |
AB2C17D24 |
-26.41 |
2.91 |
-8.55 |
-0.4 |
0 |
|
|
286185 |
104158786 |
1 |
O2N5C12H19 |
A2B5C12D19 |
-16.31 |
5.62 |
-8.63 |
-1.03 |
0 |
|
|
286186 |
104158884 |
1 |
ON3C12H21 |
AB3C12D21 |
-39.46 |
5.88 |
-8.99 |
0.08 |
0 |
|
|
286187 |
104158894 |
1 |
N3O3C13H21 |
A3B3C13D21 |
-98.35 |
7.42 |
-8.99 |
-0.63 |
0 |
|
|
286188 |
104158895 |
1 |
FN3H14C15 |
AB3C14D15 |
34.94 |
3.66 |
-9.62 |
-1.01 |
0 |
|
|
286189 |
104158972 |
1 |
ON3C15H29 |
AB3C15D29 |
-43.43 |
0.52 |
-8.8 |
0.99 |
0 |
|
|
286190 |
104159023 |
1 |
NO2C17H29 |
AB2C17D29 |
-99.9 |
1.75 |
-8.48 |
0.47 |
0 |
|
|
286191 |
104159142 |
1 |
NO2C12H25 |
AB2C12D25 |
-117.44 |
2.88 |
-9.15 |
2.2 |
0 |
|
|
286192 |
104159278 |
1 |
ON4C13H14 |
AB4C13D14 |
30.66 |
4.29 |
-9.22 |
-0.64 |
0 |
|
|
286193 |
104159305 |
1 |
ClON4H9C11 |
ABC4D9E11 |
18.6 |
7.52 |
-8.79 |
-1.15 |
0 |
|
|
286194 |
104159444 |
1 |
ON4C15H16 |
AB4C15D16 |
17.29 |
4.69 |
-8.34 |
-0.78 |
0 |
|
|
286195 |
104159622 |
1 |
OF3N4C7H7 |
AB3C4D7E7 |
-160.72 |
6.25 |
-9.59 |
-1.1 |
0 |
|
|
286196 |
104159639 |
1 |
ON4C13H20 |
AB4C13D20 |
1.73 |
4.12 |
-9.25 |
-0.7 |
0 |
|
|
286197 |
104159647 |
1 |
ON4C15H24 |
AB4C15D24 |
-30.55 |
4.02 |
-9.32 |
-0.66 |
0 |
|
|
286198 |
104159731 |
1 |
ON4C11H16 |
AB4C11D16 |
3.22 |
4.68 |
-9.34 |
-0.81 |
0 |
|
|
286199 |
104160129 |
1 |
BrNSO4C14H22 |
ABCD4E14F22 |
-156.64 |
7.25 |
-9.57 |
-0.64 |
0 |