List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
417020 |
135091100 |
1 |
O2N3C14H23 |
A2B3C14D23 |
-77.3 |
3.28 |
-9.25 |
0.48 |
0 |
|
|
417021 |
135091101 |
1 |
O2N3C23H25 |
A2B3C23D25 |
-5.74 |
4.27 |
-8.37 |
-0.01 |
0 |
|
|
417022 |
135091103 |
2 |
ON3C9H15 |
AB3C9D15 |
-60.33 |
3.59 |
-8.67 |
0.28 |
0 |
|
|
417023 |
135091104 |
1 |
N2O5C20H28 |
A2B5C20D28 |
-204.11 |
1.63 |
-8.42 |
0.02 |
0 |
|
|
417024 |
135091105 |
1 |
ClO2N4C19H23 |
AB2C4D19E23 |
-57.06 |
4.99 |
-9.34 |
-0.61 |
0 |
|
|
417025 |
135091113 |
1 |
NO3C22H27 |
AB3C22D27 |
-113.18 |
4.0 |
-9.05 |
0.08 |
0 |
|
|
417026 |
135091117 |
1 |
O2N4C23H32 |
A2B4C23D32 |
-48.96 |
2.04 |
-9.02 |
-0.28 |
0 |
|
|
417027 |
135091119 |
1 |
FOSN2C20H25 |
ABCD2E20F25 |
-41.56 |
2.6 |
-8.88 |
-0.09 |
0 |
|
|
417028 |
135091121 |
1 |
O3N4C17H24 |
A3B4C17D24 |
-85.7 |
5.91 |
-9.43 |
-0.56 |
0 |
|
|
417029 |
135091136 |
1 |
SO2N3C14H17 |
AB2C3D14E17 |
-30.94 |
2.07 |
-8.94 |
-0.52 |
0 |
|
|
417030 |
135091139 |
1 |
ClN3O4C18H22 |
AB3C4D18E22 |
-101.09 |
2.74 |
-9.55 |
-1.18 |
0 |
|
|
417031 |
135091140 |
1 |
N2O4C19H20 |
A2B4C19D20 |
-90.68 |
2.5 |
-8.62 |
-0.71 |
0 |
|
|
417032 |
135091141 |
1 |
ClON4C17H23 |
ABC4D17E23 |
-20.89 |
3.45 |
-8.95 |
-0.6 |
0 |
|
|
417033 |
135091142 |
1 |
NSO3C20H23 |
ABC3D20E23 |
-88.36 |
6.49 |
-8.96 |
-0.25 |
0 |
|
|
417034 |
135091143 |
1 |
F2O2N3C17H19 |
A2B2C3D17E19 |
-137.54 |
4.92 |
-9.36 |
0.01 |
0 |
|
|
417035 |
135091144 |
2 |
N2O2C11H15 |
A2B2C11D15 |
-94.42 |
2.08 |
-9.08 |
-0.87 |
0 |
|
|
417036 |
135091145 |
1 |
O2N3F6H15C16 |
A2B3C6D15E16 |
-365.84 |
1.27 |
-9.69 |
-1.31 |
0 |
|
|
417037 |
135091146 |
3 |
N2O2C11H16 |
A2B2C11D16 |
-271.45 |
8.46 |
-9.44 |
0.12 |
0 |
|
|
417038 |
135091147 |
1 |
OSN4C15H18 |
ABC4D15E18 |
13.0 |
4.97 |
-8.73 |
-0.39 |
0 |
|
|
417039 |
135091148 |
1 |
SN2O4C18H26 |
AB2C4D18E26 |
-168.65 |
2.01 |
-9.57 |
-0.72 |
0 |
|
|
417040 |
135091149 |
1 |
OF3N3C20H24 |
AB3C3D20E24 |
-175.51 |
7.89 |
-8.98 |
-0.98 |
0 |
|
|
417041 |
135091150 |
1 |
N4O4C19H28 |
A4B4C19D28 |
-138.58 |
2.86 |
-9.77 |
-0.03 |
0 |
|
|
417042 |
135091196 |
1 |
O4N8C31H38 |
A4B8C31D38 |
-75.64 |
8.97 |
-8.25 |
-0.76 |
0 |
|
|
417043 |
135091214 |
1 |
NO4C23H27 |
AB4C23D27 |
-155.83 |
5.6 |
-9.29 |
-0.32 |
0 |
|
|
417044 |
135091215 |
1 |
O2N5C18H19 |
A2B5C18D19 |
33.7 |
3.48 |
-9.27 |
-0.9 |
0 |
|
|
417045 |
135091216 |
1 |
N5O7C34H47 |
A5B7C34D47 |
-277.19 |
3.19 |
-8.81 |
-0.81 |
0 |
|
|
417046 |
135091217 |
1 |
SO2N4C14H16 |
AB2C4D14E16 |
-25.05 |
9.31 |
-8.83 |
-0.57 |
0 |
|
|
417047 |
135091218 |
1 |
N3O5C21H29 |
A3B5C21D29 |
-210.95 |
9.47 |
-9.29 |
-0.61 |
0 |
|
|
417049 |
135091226 |
1 |
FO2N3C15H18 |
AB2C3D15E18 |
-54.63 |
3.28 |
-9.65 |
-0.25 |
0 |
|
|
417050 |
135091228 |
1 |
SN3O3C18H23 |
AB3C3D18E23 |
-81.22 |
1.83 |
-8.9 |
-1.0 |
0 |
|
|
417051 |
135091229 |
1 |
SN4O4C15H26 |
AB4C4D15E26 |
-155.89 |
8.32 |
-9.33 |
0.32 |
0 |
|
|
417052 |
135091230 |
1 |
ON4C19H26 |
AB4C19D26 |
46.71 |
3.65 |
-8.99 |
-0.28 |
0 |
|
|
417053 |
135091231 |
1 |
N5C22H23 |
A5B22C23 |
99.52 |
2.66 |
-8.65 |
-0.85 |
0 |
|
|
417054 |
135091232 |
1 |
NSO3C18H27 |
ABC3D18E27 |
-146.15 |
1.04 |
-9.05 |
-0.23 |
0 |
|
|
417055 |
135091233 |
1 |
N3O3C20H29 |
A3B3C20D29 |
-91.68 |
5.93 |
-8.06 |
0.29 |
0 |
|
|
417056 |
135091234 |
1 |
ClNO5C18H26 |
ABC5D18E26 |
-212.59 |
2.32 |
-9.07 |
-0.34 |
0 |
|
|
417057 |
135091235 |
1 |
FN2O5C19H23 |
AB2C5D19E23 |
-190.57 |
4.66 |
-9.23 |
-1.44 |
0 |
|
|
417058 |
135091236 |
1 |
O6N7C31H45 |
A6B7C31D45 |
-262.02 |
3.6 |
-8.65 |
-0.21 |
0 |
|
|
417059 |
135091237 |
1 |
NO2C21H31 |
AB2C21D31 |
-115.87 |
4.71 |
-8.72 |
0.7 |
0 |
|
|
417060 |
135091238 |
1 |
N3O4C18H21 |
A3B4C18D21 |
-79.73 |
5.85 |
-9.15 |
-1.03 |
0 |
|
|
417061 |
135091239 |
1 |
O5N7C35H41 |
A5B7C35D41 |
-161.93 |
6.12 |
-8.45 |
-1.55 |
0 |
|
|
417062 |
135091240 |
1 |
O2N5C20H29 |
A2B5C20D29 |
-50.46 |
9.13 |
-9.34 |
-0.78 |
0 |
|
|
417063 |
135091241 |
1 |
N3O3C23H29 |
A3B3C23D29 |
-84.32 |
2.28 |
-8.28 |
-0.43 |
0 |
|
|
417064 |
135091242 |
1 |
ClN2O4C18H21 |
AB2C4D18E21 |
-130.96 |
7.46 |
-8.8 |
-0.5 |
0 |
|
|
417065 |
135091243 |
1 |
SO4N5C30H37 |
AB4C5D30E37 |
-140.45 |
10.09 |
-8.3 |
-0.48 |
0 |
|
|
417066 |
135091244 |
1 |
SN3O3C18H21 |
AB3C3D18E21 |
-74.98 |
9.3 |
-8.58 |
-0.4 |
0 |
|
|
417067 |
135091245 |
1 |
ON6C15H16 |
AB6C15D16 |
61.33 |
6.46 |
-9.16 |
-0.8 |
0 |
|
|
417068 |
135091246 |
1 |
N2O3C22H28 |
A2B3C22D28 |
-82.52 |
2.57 |
-9.18 |
-0.21 |
0 |
|
|
417069 |
135091247 |
1 |
N6O7C37H52 |
A6B7C37D52 |
-229.4 |
4.81 |
-8.67 |
-0.49 |
0 |
|
|
417070 |
135091248 |
1 |
S2O7N8C38H46 |
A2B7C8D38E46 |
-206.33 |
12.51 |
-8.39 |
-1.57 |
0 |
|
|
417071 |
135091249 |
1 |
SN2O4C19H22 |
AB2C4D19E22 |
-117.53 |
6.39 |
-10.03 |
-0.85 |
0 |
|
|
417072 |
135091251 |
1 |
FN3O5C19H24 |
AB3C5D19E24 |
-181.96 |
4.71 |
-9.13 |
-1.25 |
0 |
|
|
417073 |
135091252 |
1 |
SO5N6C31H38 |
AB5C6D31E38 |
-147.85 |
10.05 |
-9.35 |
-1.14 |
0 |
|
|
417074 |
135091253 |
1 |
F2O2N3C15H19 |
A2B2C3D15E19 |
-147.44 |
7.23 |
-8.74 |
-0.4 |
0 |
|
|
417075 |
135091256 |
1 |
ClON5C13H20 |
ABC5D13E20 |
-10.05 |
1.9 |
-8.53 |
-0.14 |
0 |
|
|
417076 |
135091258 |
1 |
ON3C21H23 |
AB3C21D23 |
23.53 |
2.9 |
-8.4 |
-0.08 |
0 |
|
|
417077 |
135091281 |
1 |
N2O4C21H26 |
A2B4C21D26 |
-133.23 |
6.76 |
-9.06 |
-0.26 |
0 |
|
|
417078 |
135091283 |
1 |
N6O6C33H46 |
A6B6C33D46 |
-240.92 |
6.66 |
-9.01 |
-0.14 |
0 |
|
|
417079 |
135091287 |
1 |
SO2N4C14H22 |
AB2C4D14E22 |
-53.96 |
5.44 |
-8.58 |
-0.04 |
0 |
|
|
417080 |
135091288 |
1 |
O2N5C15H17 |
A2B5C15D17 |
-7.7 |
6.56 |
-9.67 |
-0.44 |
0 |
|
|
417081 |
135091289 |
1 |
FO2N3C12H14 |
AB2C3D12E14 |
-102.21 |
4.53 |
-9.54 |
-1.31 |
0 |
|
|
417082 |
135091290 |
1 |
SN7O7C34H47 |
AB7C7D34E47 |
-301.64 |
4.81 |
-9.44 |
-0.61 |
0 |
|
|
417083 |
135091291 |
1 |
N6O7C39H44 |
A6B7C39D44 |
-203.91 |
6.51 |
-8.59 |
-0.3 |
0 |
|
|
417084 |
135091292 |
2 |
N2O2C7H8 |
A2B2C7D8 |
-80.89 |
3.84 |
-9.79 |
-1.4 |
0 |
|
|
417085 |
135091293 |
1 |
FN4O6C29H35 |
AB4C6D29E35 |
-262.8 |
9.3 |
-9.32 |
-0.82 |
0 |
|
|
417086 |
135091294 |
1 |
FN3O3C19H24 |
AB3C3D19E24 |
-111.38 |
4.19 |
-8.74 |
-0.04 |
0 |
|
|
417087 |
135091295 |
1 |
O2N4C21H26 |
A2B4C21D26 |
-15.76 |
4.13 |
-9.26 |
-0.57 |
0 |
|
|
417088 |
135091296 |
1 |
O7N9C38H45 |
A7B9C38D45 |
-69.86 |
5.25 |
-8.54 |
-2.52 |
0 |
|
|
417089 |
135091297 |
1 |
ON2C19H24 |
AB2C19D24 |
-19.0 |
3.8 |
-8.05 |
-0.24 |
0 |
|
|
417090 |
135091298 |
1 |
SN2O5C19H26 |
AB2C5D19E26 |
-188.4 |
4.57 |
-9.01 |
-0.37 |
0 |
|
|
417091 |
135091299 |
1 |
O3N5C15H17 |
A3B5C15D17 |
62.31 |
7.75 |
-9.49 |
-1.35 |
0 |
|
|
417092 |
135091300 |
1 |
SN3O3C15H19 |
AB3C3D15E19 |
-78.29 |
1.74 |
-8.53 |
-0.01 |
0 |
|
|
417093 |
135091301 |
1 |
N5O7C31H47 |
A5B7C31D47 |
-320.63 |
4.85 |
-8.95 |
0.0 |
0 |
|
|
417094 |
135091302 |
2 |
N3O3C20H28 |
A3B3C20D28 |
-277.82 |
6.88 |
-8.76 |
-0.47 |
0 |
|
|
417095 |
135091359 |
1 |
FN5O5C31H32 |
AB5C5D31E32 |
-152.68 |
9.67 |
-8.62 |
-0.86 |
0 |
|
|
417096 |
135091363 |
1 |
ON4C17H22 |
AB4C17D22 |
10.34 |
1.79 |
-8.98 |
-0.14 |
0 |
|
|
417097 |
135091366 |
1 |
ClO2N3C18H22 |
AB2C3D18E22 |
-62.31 |
5.61 |
-9.09 |
-1.14 |
0 |
|
|
417098 |
135091367 |
1 |
ON3C14H21 |
AB3C14D21 |
-8.55 |
5.88 |
-9.02 |
0.94 |
0 |
|
|
417100 |
135091369 |
1 |
N2O5C18H24 |
A2B5C18D24 |
-220.55 |
5.47 |
-9.76 |
-0.17 |
0 |
|
|
417101 |
135091370 |
1 |
ClFO2N3C16H17 |
ABC2D3E16F17 |
-94.31 |
5.6 |
-9.66 |
-0.84 |
0 |
|
|
417102 |
135091378 |
1 |
FOSN2C15H19 |
ABCD2E15F19 |
-69.88 |
4.84 |
-8.65 |
-0.27 |
0 |
|
|
417103 |
135091380 |
1 |
O2N5C15H21 |
A2B5C15D21 |
-9.31 |
5.03 |
-8.77 |
0.1 |
0 |
|
|
417104 |
135091382 |
1 |
ON4C21H28 |
AB4C21D28 |
6.14 |
2.23 |
-8.82 |
-0.06 |
0 |
|
|
417105 |
135091385 |
1 |
SO7N9C38H47 |
AB7C9D38E47 |
-208.65 |
5.83 |
-8.42 |
-1.5 |
0 |
|
|
417107 |
135091387 |
1 |
O4N6C19H22 |
A4B6C19D22 |
-43.03 |
4.6 |
-9.08 |
-1.14 |
0 |
|
|
417108 |
135091388 |
1 |
N6C17H22 |
A6B17C22 |
91.34 |
3.31 |
-8.59 |
-0.27 |
0 |
|
|
417109 |
135091389 |
1 |
FON5C16H20 |
ABC5D16E20 |
-35.14 |
7.31 |
-8.85 |
-0.35 |
0 |
|
|
417110 |
135091390 |
1 |
O2N6C19H24 |
A2B6C19D24 |
-19.52 |
4.52 |
-8.76 |
-0.29 |
0 |
|
|
417111 |
135091391 |
1 |
NO5C14H19 |
AB5C14D19 |
-199.22 |
3.73 |
-8.65 |
-0.02 |
0 |
|
|
417112 |
135091392 |
1 |
O3N5C17H21 |
A3B5C17D21 |
-83.14 |
7.43 |
-9.44 |
-0.49 |
0 |
|
|
417114 |
135091394 |
1 |
FN2O3C20H21 |
AB2C3D20E21 |
-114.48 |
3.13 |
-9.17 |
-0.54 |
0 |
|
|
417115 |
135091395 |
1 |
N5O6C32H39 |
A5B6C32D39 |
-112.97 |
8.05 |
-8.5 |
-0.8 |
0 |
|
|
417116 |
135091396 |
1 |
O3N4C20H26 |
A3B4C20D26 |
-58.62 |
3.68 |
-8.54 |
-0.47 |
0 |
|
|
417117 |
135091397 |
1 |
FO3N4C21H27 |
AB3C4D21E27 |
-85.51 |
5.41 |
-8.63 |
-1.01 |
0 |
|
|
417118 |
135091398 |
2 |
NO2C8H9 |
AB2C8D9 |
-109.3 |
4.11 |
-9.68 |
-0.69 |
0 |
|
|
417119 |
135091399 |
1 |
ClON4C20H25 |
ABC4D20E25 |
0.87 |
1.17 |
-8.53 |
-0.2 |
0 |
|
|
417120 |
135091400 |
1 |
S3O6N7C28H37 |
A3B6C7D28E37 |
-154.34 |
3.13 |
-8.81 |
-1.32 |
0 |
|
|
417121 |
135091401 |
1 |
NO3C19H29 |
AB3C19D29 |
-146.87 |
4.3 |
-8.85 |
0.4 |
0 |
|
|
417122 |
135091402 |
1 |
SO2N4C17H20 |
AB2C4D17E20 |
-17.78 |
4.42 |
-9.21 |
-1.47 |
0 |
|
|
417123 |
135091403 |
1 |
SO2N4C19H22 |
AB2C4D19E22 |
-18.69 |
2.82 |
-9.02 |
-0.95 |
0 |