List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
248125 |
103079098 |
1 |
ON3C9H17 |
AB3C9D17 |
-19.39 |
1.98 |
-7.97 |
0.84 |
0 |
|
|
248126 |
103079100 |
1 |
O2N3C10H19 |
A2B3C10D19 |
-48.97 |
1.29 |
-8.09 |
0.71 |
0 |
|
|
248127 |
103079101 |
1 |
ON3C10H19 |
AB3C10D19 |
-18.72 |
2.16 |
-8.15 |
0.77 |
0 |
|
|
248128 |
103079111 |
1 |
ION3C10H10 |
ABC3D10E10 |
57.7 |
5.22 |
-8.63 |
-0.79 |
0 |
|
|
248129 |
103079121 |
1 |
ClON3C12H14 |
ABC3D12E14 |
10.39 |
4.2 |
-8.56 |
0.27 |
0 |
|
|
248130 |
103079128 |
1 |
ClON3H12C14 |
ABC3D12E14 |
49.45 |
4.42 |
-8.42 |
-0.54 |
0 |
|
|
248131 |
103079139 |
1 |
ON4C9H18 |
AB4C9D18 |
3.38 |
2.47 |
-8.03 |
0.75 |
0 |
|
|
248132 |
103079157 |
1 |
ON3C13H17 |
AB3C13D17 |
22.96 |
2.98 |
-8.44 |
0.38 |
0 |
|
|
248133 |
103079168 |
1 |
O2N3C9H17 |
A2B3C9D17 |
-45.67 |
3.85 |
-8.17 |
0.63 |
0 |
|
|
248134 |
103079179 |
1 |
ON3C12H21 |
AB3C12D21 |
-23.07 |
2.05 |
-8.02 |
0.82 |
0 |
|
|
248135 |
103079194 |
1 |
ON4C10H20 |
AB4C10D20 |
-3.41 |
2.72 |
-7.99 |
0.79 |
0 |
|
|
248136 |
103079209 |
1 |
OF3N3C8H12 |
AB3C3D8E12 |
-165.68 |
5.05 |
-8.23 |
0.54 |
0 |
|
|
248137 |
103079218 |
1 |
N3O4C13H17 |
A3B4C13D17 |
-70.94 |
5.13 |
-8.34 |
0.32 |
0 |
|
|
248138 |
103079231 |
1 |
BrFON3H9C10 |
ABCD3E9F10 |
0.06 |
3.97 |
-8.66 |
-0.33 |
0 |
|
|
248139 |
103079232 |
1 |
O2N3C7H11 |
A2B3C7D11 |
-10.73 |
3.75 |
-8.25 |
0.51 |
0 |
|
|
248140 |
103079234 |
1 |
ON3F4H9C11 |
AB3C4D9E11 |
-165.88 |
8.11 |
-8.81 |
-0.82 |
0 |
|
|
248141 |
103079241 |
1 |
N4O4C7H10 |
A4B4C7D10 |
-46.58 |
7.1 |
-9.3 |
-1.06 |
0 |
|
|
248142 |
103079244 |
2 |
N2O2C5H8 |
A2B2C5D8 |
-72.12 |
10.37 |
-8.91 |
-0.72 |
0 |
|
|
248143 |
103079248 |
1 |
N4O5C10H14 |
A4B5C10D14 |
-88.96 |
7.51 |
-9.32 |
-1.06 |
0 |
|
|
248144 |
103079250 |
4 |
NOC2H3 |
ABC2D3 |
-68.61 |
4.26 |
-9.48 |
-1.09 |
0 |
|
|
248145 |
103079273 |
1 |
N4O4C11H16 |
A4B4C11D16 |
-67.89 |
10.71 |
-9.29 |
-1.13 |
0 |
|
|
248146 |
103079274 |
2 |
N2O2C6H9 |
A2B2C6D9 |
-74.31 |
7.54 |
-9.57 |
-1.16 |
0 |
|
|
248147 |
103079280 |
2 |
N2O2C6H9 |
A2B2C6D9 |
-76.26 |
7.8 |
-9.35 |
-1.04 |
0 |
|
|
248148 |
103079281 |
1 |
N4O4C13H20 |
A4B4C13D20 |
-80.89 |
3.83 |
-9.56 |
-1.1 |
0 |
|
|
248149 |
103079282 |
2 |
N2O2C5H7 |
A2B2C5D7 |
-60.18 |
4.77 |
-8.99 |
-0.84 |
0 |
|
|
248150 |
103079287 |
2 |
N2O2C5H8 |
A2B2C5D8 |
-68.06 |
7.93 |
-9.11 |
-0.79 |
0 |
|
|
248151 |
103079293 |
1 |
N4O4C9H14 |
A4B4C9D14 |
-57.15 |
6.84 |
-9.25 |
-1.03 |
0 |
|
|
248152 |
103079304 |
1 |
N4O4C11H16 |
A4B4C11D16 |
-65.1 |
4.87 |
-9.04 |
-0.83 |
0 |
|
|
248153 |
103079306 |
1 |
N4O4C9H12 |
A4B4C9D12 |
-32.83 |
10.09 |
-9.41 |
-0.95 |
0 |
|
|
248154 |
103079314 |
1 |
N4O4C11H16 |
A4B4C11D16 |
-59.67 |
8.09 |
-9.01 |
-0.9 |
0 |
|
|
248155 |
103079318 |
2 |
N2O2C6H9 |
A2B2C6D9 |
-64.12 |
5.64 |
-8.87 |
-0.8 |
0 |
|
|
248156 |
103079319 |
1 |
N4O4C13H20 |
A4B4C13D20 |
-71.81 |
5.1 |
-9.0 |
-0.89 |
0 |
|
|
248157 |
103079321 |
2 |
N2O2C6H9 |
A2B2C6D9 |
-67.62 |
8.37 |
-9.36 |
-1.03 |
0 |
|
|
248158 |
103079330 |
1 |
N4O4C9H14 |
A4B4C9D14 |
-71.61 |
6.77 |
-9.19 |
-0.94 |
0 |
|
|
248159 |
103079332 |
2 |
N2O2C4H5 |
A2B2C4D5 |
-31.35 |
7.56 |
-9.62 |
-1.13 |
0 |
|
|
248160 |
103079336 |
1 |
N4O4C11H18 |
A4B4C11D18 |
-78.34 |
9.77 |
-9.05 |
-0.79 |
0 |
|
|
248161 |
103079344 |
2 |
N2O2C5H7 |
A2B2C5D7 |
-40.67 |
7.57 |
-9.52 |
-1.14 |
0 |
|
|
248162 |
103079345 |
1 |
N4O4C9H14 |
A4B4C9D14 |
-74.92 |
6.43 |
-9.21 |
-0.91 |
0 |
|
|
248163 |
103079347 |
2 |
N2O2C5H7 |
A2B2C5D7 |
-66.7 |
5.01 |
-9.55 |
-1.11 |
0 |
|
|
248164 |
103079348 |
2 |
N2O2C5H8 |
A2B2C5D8 |
-72.93 |
5.87 |
-9.52 |
-1.09 |
0 |
|
|
248165 |
103079351 |
4 |
NOC3H5 |
ABC3D5 |
-84.12 |
9.9 |
-9.03 |
-0.78 |
0 |
|
|
248166 |
103079359 |
2 |
N2O2C5H7 |
A2B2C5D7 |
-57.46 |
6.29 |
-8.87 |
-0.73 |
0 |
|
|
248167 |
103079364 |
1 |
N4O5C10H14 |
A4B5C10D14 |
-95.71 |
4.7 |
-9.47 |
-1.11 |
0 |
|
|
248168 |
103079381 |
1 |
N4O5C10H10 |
A4B5C10D10 |
-51.0 |
10.72 |
-9.44 |
-1.09 |
0 |
|
|
248169 |
103079405 |
1 |
N4O4C13H20 |
A4B4C13D20 |
-79.14 |
6.05 |
-9.49 |
-1.06 |
0 |
|
|
248170 |
103079429 |
4 |
NOC3H4 |
ABC3D4 |
-55.65 |
8.89 |
-9.22 |
-0.95 |
0 |
|
|
248171 |
103079430 |
1 |
O2N5C13H13 |
A2B5C13D13 |
94.77 |
5.05 |
-9.04 |
-0.86 |
0 |
|
|
248172 |
103079432 |
1 |
O2N5C9H13 |
A2B5C9D13 |
58.84 |
9.69 |
-9.07 |
-0.85 |
0 |
|
|
248173 |
103079435 |
1 |
O2N5C11H17 |
A2B5C11D17 |
46.37 |
9.42 |
-9.1 |
-0.91 |
0 |
|
|
248174 |
103079441 |
1 |
O2N6C11H16 |
A2B6C11D16 |
67.75 |
9.62 |
-8.81 |
-0.86 |
0 |
|
|
248175 |
103079442 |
2 |
ON3C6H9 |
AB3C6D9 |
60.75 |
5.58 |
-8.95 |
-0.77 |
0 |
|
|
248176 |
103079447 |
1 |
O3N5C9H11 |
A3B5C9D11 |
36.51 |
10.06 |
-9.27 |
-1.01 |
0 |
|
|
248177 |
103079458 |
1 |
SN4O4H8C10 |
AB4C4D8E10 |
-7.51 |
9.11 |
-9.41 |
-1.46 |
0 |
|
|
248178 |
103079469 |
1 |
SN3O4C10H13 |
AB3C4D10E13 |
-41.11 |
5.42 |
-8.98 |
-1.06 |
0 |
|
|
248179 |
103079470 |
1 |
SO4N7C8H9 |
AB4C7D8E9 |
41.26 |
11.38 |
-9.41 |
-1.62 |
0 |
|
|
248180 |
103079482 |
1 |
SN3O4H11C12 |
AB3C4D11E12 |
-29.63 |
5.65 |
-8.94 |
-1.2 |
0 |
|
|
248181 |
103079486 |
1 |
O2N5C6H11 |
A2B5C6D11 |
31.86 |
7.27 |
-9.02 |
-0.78 |
0 |
|
|
248182 |
103079500 |
1 |
BrN3O3H10C14 |
AB3C3D10E14 |
57.57 |
8.41 |
-9.16 |
-1.03 |
0 |
|
|
248183 |
103079519 |
1 |
SN3C10H11 |
AB3C10D11 |
70.31 |
3.69 |
-8.32 |
0.23 |
0 |
|
|
248184 |
103079528 |
1 |
SN6C12H16 |
AB6C12D16 |
127.99 |
6.03 |
-8.36 |
-0.07 |
0 |
|
|
248185 |
103079529 |
1 |
OSN3C11H13 |
ABC3D11E13 |
32.05 |
3.38 |
-7.96 |
-0.1 |
0 |
|
|
248186 |
103079536 |
1 |
OSN5C11H15 |
ABC5D11E15 |
20.81 |
11.66 |
-8.84 |
-0.52 |
0 |
|
|
248187 |
103079537 |
1 |
SN4C9H10 |
AB4C9D10 |
80.9 |
5.45 |
-8.43 |
-0.31 |
0 |
|
|
248188 |
103079539 |
1 |
SN6C7H10 |
AB6C7D10 |
98.24 |
9.27 |
-8.47 |
-0.12 |
0 |
|
|
248189 |
103079542 |
1 |
OSN5C9H11 |
ABC5D9E11 |
33.58 |
12.27 |
-8.52 |
-0.54 |
0 |
|
|
248190 |
103079561 |
1 |
SN3C4H7 |
AB3C4D7 |
52.2 |
4.93 |
-8.21 |
-0.84 |
0 |
|
|
248191 |
103079566 |
1 |
SO2N3C8H13 |
AB2C3D8E13 |
-49.02 |
2.78 |
-8.29 |
0.26 |
0 |
|
|
248192 |
103079575 |
1 |
S2N4C7H8 |
A2B4C7D8 |
87.67 |
3.42 |
-8.36 |
-0.59 |
0 |
|
|
248193 |
103079580 |
1 |
SN6C7H10 |
AB6C7D10 |
92.14 |
4.18 |
-8.22 |
0.12 |
0 |
|
|
248194 |
103079596 |
1 |
OSN6C9H14 |
ABC6D9E14 |
30.81 |
4.56 |
-8.61 |
-0.28 |
0 |
|
|
248195 |
103079599 |
1 |
SN3C10H17 |
AB3C10D17 |
25.37 |
2.55 |
-7.96 |
0.53 |
0 |
|
|
248196 |
103079600 |
1 |
SN5C8H9 |
AB5C8D9 |
92.82 |
4.63 |
-8.42 |
-0.74 |
0 |
|
|
248197 |
103079628 |
1 |
OSN3C7H13 |
ABC3D7E13 |
-14.95 |
4.58 |
-8.55 |
0.24 |
0 |
|
|
248198 |
103079631 |
1 |
ClSN3C11H12 |
ABC3D11E12 |
56.2 |
5.2 |
-8.0 |
-0.25 |
0 |
|
|
248199 |
103079634 |
2 |
ClON2C6H6 |
ABC2D6E6 |
32.06 |
6.39 |
-9.08 |
-0.8 |
0 |