List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
379091 |
134352338 |
1 |
NH37C53 |
AB37C53 |
222.22 |
0.56 |
-7.95 |
-0.72 |
0 |
|
|
379095 |
134352344 |
1 |
NH45C66 |
AB45C66 |
281.76 |
1.39 |
-7.9 |
-0.78 |
0 |
|
|
379096 |
134352345 |
1 |
NH41C61 |
AB41C61 |
256.19 |
0.7 |
-8.08 |
-0.73 |
0 |
|
|
379098 |
134352352 |
1 |
NO2H37C59 |
AB2C37D59 |
193.85 |
1.74 |
-8.1 |
-0.81 |
0 |
|
|
379099 |
134352359 |
1 |
NSH35C53 |
ABC35D53 |
226.07 |
1.26 |
-8.04 |
-0.78 |
0 |
|
|
379100 |
134352365 |
1 |
F2N7O10C41H51 |
A2B7C10D41E51 |
-466.51 |
3.16 |
-8.71 |
-0.74 |
0 |
|
|
379101 |
134352370 |
1 |
NH43C63 |
AB43C63 |
262.01 |
0.98 |
-8.03 |
-0.71 |
0 |
|
|
379102 |
134352372 |
1 |
NH45C66 |
AB45C66 |
280.27 |
0.53 |
-7.9 |
-0.73 |
0 |
|
|
379103 |
134352375 |
1 |
N3H39C61 |
A3B39C61 |
273.18 |
1.39 |
-8.14 |
-0.77 |
0 |
|
|
379104 |
134352377 |
1 |
N2H32C49 |
A2B32C49 |
318.83 |
3.92 |
-7.76 |
-1.22 |
0 |
|
|
379105 |
134352383 |
2 |
N2H13C21 |
A2B13C21 |
229.29 |
2.51 |
-8.86 |
-1.31 |
0 |
|
|
379106 |
134352385 |
1 |
BrH19C29 |
AB19C29 |
121.2 |
1.92 |
-8.53 |
-0.8 |
0 |
|
|
379107 |
134352388 |
1 |
NH27C41 |
AB27C41 |
177.89 |
1.49 |
-8.1 |
-0.8 |
0 |
|
|
379110 |
134352409 |
2 |
O10C21H22 |
A10B21C22 |
-776.73 |
5.64 |
-9.57 |
-1.1 |
0 |
|
|
379111 |
134352417 |
1 |
O12C37H38 |
A12B37C38 |
-410.25 |
3.52 |
-9.06 |
-0.76 |
0 |
|
|
379112 |
134352420 |
4 |
O5C12H14 |
A5B12C14 |
-817.24 |
5.14 |
-9.49 |
-0.96 |
0 |
|
|
379113 |
134352421 |
2 |
O6C17H18 |
A6B17C18 |
-426.92 |
4.18 |
-9.33 |
-0.93 |
0 |
|
|
379114 |
134352426 |
1 |
PF2N5O11C32H44 |
AB2C5D11E32F44 |
-635.98 |
7.61 |
-9.41 |
-0.37 |
0 |
|
|
379116 |
134352434 |
2 |
O10C29H33 |
A10B29C33 |
-819.13 |
3.89 |
-8.93 |
-0.46 |
0 |
|
|
379121 |
134352547 |
1 |
FN3O5C12H16 |
AB3C5D12E16 |
-199.32 |
2.54 |
-10.08 |
-0.98 |
0 |
|
|
379122 |
134352548 |
1 |
FN3O5C12H16 |
AB3C5D12E16 |
-202.71 |
2.23 |
-10.03 |
-0.83 |
0 |
|
|
379123 |
134352550 |
2 |
NO2C5H8 |
AB2C5D8 |
-182.96 |
3.44 |
-9.87 |
-0.05 |
0 |
|
|
379124 |
134353301 |
1 |
SF3N6C23H29 |
AB3C6D23E29 |
-87.01 |
5.07 |
-8.62 |
-0.81 |
0 |
|
|
379125 |
134353318 |
1 |
SF3N5C21H28 |
AB3C5D21E28 |
-110.93 |
4.95 |
-8.72 |
-0.88 |
0 |
|
|
379126 |
134353324 |
1 |
SO2F3N5C27H38 |
AB2C3D5E27F38 |
-217.78 |
5.4 |
-8.85 |
-1.01 |
0 |
|
|
379127 |
134353457 |
1 |
NC27H31 |
AB27C31 |
51.03 |
1.73 |
-8.64 |
0.2 |
0 |
|
|
379128 |
134353462 |
1 |
OSN6H64C110 |
ABC6D64E110 |
480.78 |
1.35 |
-8.07 |
-0.73 |
0 |
|
|
379129 |
134353471 |
1 |
ON5H39C59 |
AB5C39D59 |
273.42 |
1.15 |
-8.04 |
-1.2 |
0 |
|
|
379130 |
134353474 |
1 |
SN4H36C54 |
AB4C36D54 |
358.11 |
3.07 |
-7.82 |
-0.85 |
0 |
|
|
379131 |
134353532 |
1 |
N5O6C25H41 |
A5B6C25D41 |
-242.96 |
4.27 |
-9.89 |
-0.64 |
0 |
|
|
379132 |
134353561 |
1 |
F2O6N7C38H49 |
A2B6C7D38E49 |
-45.52 |
25.74 |
-7.51 |
-2.19 |
0 |
|
|
379133 |
134353562 |
1 |
F2O6N7C38H49 |
A2B6C7D38E49 |
-96.51 |
30.43 |
-6.43 |
-2.22 |
0 |
|
|
379134 |
134353689 |
1 |
SN7O8C44H49 |
AB7C8D44E49 |
-200.18 |
4.46 |
-8.57 |
-0.49 |
0 |
|
|
379135 |
134354005 |
1 |
O2N3C12H15 |
A2B3C12D15 |
-26.96 |
4.15 |
-8.92 |
-0.34 |
0 |
|
|
379136 |
134354294 |
2 |
NH10C17 |
AB10C17 |
159.7 |
2.38 |
-8.28 |
-1.12 |
0 |
|
|
379137 |
134354295 |
2 |
NH10C17 |
AB10C17 |
153.39 |
3.45 |
-7.7 |
-0.97 |
0 |
|
|
379138 |
134354306 |
1 |
N3H35C59 |
A3B35C59 |
293.03 |
5.33 |
-8.03 |
-1.19 |
0 |
|
|
379139 |
134354430 |
1 |
FON4C30H41 |
ABC4D30E41 |
-53.48 |
4.9 |
-7.47 |
-0.47 |
0 |
|
|
379140 |
134354489 |
1 |
N4H38C55 |
A4B38C55 |
295.25 |
1.72 |
-7.91 |
-0.64 |
0 |
|
|
379141 |
134354663 |
1 |
NO4C12H21 |
AB4C12D21 |
-180.47 |
1.5 |
-8.9 |
-0.09 |
0 |
|
|
379142 |
134354800 |
1 |
N3O8H83C84 |
A3B8C83D84 |
-36.07 |
3.82 |
-7.39 |
-0.08 |
0 |
|
|
379143 |
134354891 |
1 |
ON7C22H33 |
AB7C22D33 |
28.74 |
4.37 |
-8.66 |
-0.85 |
0 |
|
|
379144 |
134354921 |
2 |
N3O4C8H14 |
A3B4C8D14 |
-289.12 |
5.68 |
-9.54 |
-0.91 |
0 |
|
|
379145 |
134354928 |
1 |
SO3N6H12C13 |
AB3C6D12E13 |
24.5 |
1.95 |
-9.1 |
-1.67 |
0 |
|
|
379146 |
134354929 |
1 |
O4N6C17H22 |
A4B6C17D22 |
-79.16 |
4.57 |
-8.45 |
-0.22 |
0 |
|
|
379147 |
134354930 |
1 |
SO3N4C16H18 |
AB3C4D16E18 |
-71.26 |
1.12 |
-8.83 |
-0.99 |
0 |
|
|
379148 |
134354934 |
1 |
F2N2C21H22 |
A2B2C21D22 |
-15.76 |
3.52 |
-8.46 |
-0.52 |
0 |
|
|
379149 |
134354938 |
1 |
F2N3O5H15C19 |
A2B3C5D15E19 |
-188.04 |
1.54 |
-10.07 |
-1.35 |
0 |
|
|
379150 |
134354941 |
1 |
SO4N6C12H18 |
AB4C6D12E18 |
-30.52 |
3.89 |
-9.47 |
-1.17 |
0 |
|
|
379151 |
134354948 |
1 |
ON8C25H32 |
AB8C25D32 |
77.11 |
6.55 |
-8.73 |
-0.89 |
0 |
|
|
379152 |
134354951 |
1 |
ON8C25H34 |
AB8C25D34 |
57.09 |
7.72 |
-8.66 |
-0.57 |
0 |
|
|
379153 |
134354953 |
1 |
ON6C27H32 |
AB6C27D32 |
58.82 |
4.72 |
-9.08 |
-1.08 |
0 |
|
|
379154 |
134354960 |
1 |
NO5C12H17 |
AB5C12D17 |
-179.4 |
4.24 |
-8.96 |
-0.67 |
0 |
|
|
379155 |
134354961 |
1 |
ON7C24H27 |
AB7C24D27 |
106.03 |
6.01 |
-9.38 |
-1.36 |
0 |
|
|
379156 |
134354981 |
1 |
F2O2N4H18C19 |
A2B2C4D18E19 |
-62.71 |
4.11 |
-9.72 |
-1.11 |
0 |
|
|
379157 |
134355009 |
1 |
N3C12H19 |
A3B12C19 |
64.19 |
2.62 |
-9.24 |
-0.18 |
0 |
|
|
379158 |
134355010 |
1 |
N4O7C10H14 |
A4B7C10D14 |
-246.56 |
8.49 |
-10.54 |
-1.32 |
0 |
|
|
379159 |
134355020 |
1 |
SN2F3O4C15H15 |
AB2C3D4E15F15 |
-276.3 |
6.35 |
-9.71 |
-1.1 |
0 |
|
|
379160 |
134355021 |
1 |
SN2O2F3C15H15 |
AB2C2D3E15F15 |
-193.78 |
1.62 |
-8.73 |
-0.84 |
0 |
|
|
379161 |
134355031 |
1 |
N3C24H25 |
A3B24C25 |
94.91 |
3.44 |
-8.73 |
-0.43 |
0 |
|
|
379162 |
134355043 |
1 |
N3H31C41 |
A3B31C41 |
306.35 |
2.03 |
-8.54 |
-1.13 |
0 |
|
|
379163 |
134355088 |
1 |
O3C20H38 |
A3B20C38 |
-203.93 |
2.03 |
-9.69 |
1.04 |
0 |
|
|
379164 |
134355348 |
1 |
FO2N6C26H27 |
AB2C6D26E27 |
-21.61 |
4.14 |
-8.9 |
-1.08 |
0 |
|
|
379165 |
134355419 |
1 |
NC14H27 |
AB14C27 |
-31.11 |
2.72 |
-9.28 |
1.07 |
0 |
|
|
379166 |
134355524 |
1 |
O10N13C36H69 |
A10B13C36D69 |
-488.49 |
10.76 |
-9.15 |
0.04 |
0 |
|
|
379167 |
134356324 |
1 |
O3N9C20H21 |
A3B9C20D21 |
1.8 |
2.0 |
-8.36 |
-1.18 |
0 |
|
|
379168 |
134356417 |
1 |
NO2C10H19 |
AB2C10D19 |
-126.47 |
2.82 |
-9.64 |
1.24 |
0 |
|
|
379169 |
134356418 |
1 |
ON8C19H24 |
AB8C19D24 |
56.9 |
6.34 |
-8.28 |
-0.55 |
0 |
|
|
379170 |
134356432 |
1 |
ClC12H19 |
AB12C19 |
-5.78 |
2.7 |
-8.91 |
0.34 |
0 |
|
|
379171 |
134356441 |
2 |
ON4C11H12 |
AB4C11D12 |
13.38 |
7.48 |
-8.4 |
-0.88 |
0 |
|
|
379172 |
134356446 |
1 |
N2F3O4C22H25 |
A2B3C4D22E25 |
-252.2 |
2.38 |
-9.24 |
-0.76 |
0 |
|
|
379173 |
134356452 |
1 |
ON7C25H25 |
AB7C25D25 |
83.81 |
1.88 |
-8.26 |
-0.6 |
0 |
|
|
379174 |
134356456 |
1 |
N2F3O5C24H33 |
A2B3C5D24E33 |
-366.66 |
2.73 |
-9.69 |
-0.99 |
0 |
|
|
379175 |
134356465 |
1 |
SF2O5N8C33H40 |
AB2C5D8E33F40 |
-200.55 |
5.99 |
-9.1 |
-1.05 |
0 |
|
|
379176 |
134356466 |
1 |
F3N3O3C20H22 |
A3B3C3D20E22 |
-197.68 |
5.03 |
-9.47 |
-1.32 |
0 |