List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
159092 |
57260145 |
1 |
SN3O7H11C13 |
AB3C7D11E13 |
-165.38 |
6.16 |
-8.8 |
-1.55 |
0 |
|
|
159093 |
57260146 |
2 |
OH5C6 |
AB5C6 |
-11.55 |
2.76 |
-9.06 |
-0.87 |
0 |
|
|
159094 |
57260147 |
1 |
S3N4O6C26H36 |
A3B4C6D26E36 |
-219.9 |
9.36 |
-9.33 |
-1.24 |
0 |
|
|
159095 |
57260149 |
1 |
O8C37H72 |
A8B37C72 |
-496.48 |
2.1 |
-10.01 |
0.39 |
0 |
|
|
159096 |
57260150 |
2 |
NOC17H27 |
ABC17D27 |
-168.69 |
5.23 |
-8.82 |
-0.11 |
0 |
|
|
159097 |
57260151 |
2 |
NO2C8H10 |
AB2C8D10 |
-76.09 |
6.63 |
-9.31 |
-1.16 |
0 |
|
|
159098 |
57260153 |
1 |
ClSN2F5O5H14C23 |
ABC2D5E5F14G23 |
-372.55 |
11.79 |
-9.24 |
-1.68 |
0 |
|
|
159099 |
57260154 |
1 |
ClSF2N2O3C30H31 |
ABC2D2E3F30G31 |
-132.12 |
5.98 |
-8.98 |
-0.78 |
0 |
|
|
159100 |
57260155 |
1 |
NO2F3H14C18 |
AB2C3D14E18 |
-191.61 |
6.2 |
-8.92 |
-1.02 |
0 |
|
|
159101 |
57260156 |
1 |
NOC34H37 |
ABC34D37 |
31.76 |
1.91 |
-8.92 |
0.29 |
0 |
|
|
159102 |
57260157 |
1 |
Cl2N3O3H23C26 |
A2B3C3D23E26 |
-3.7 |
5.31 |
-8.84 |
-0.61 |
0 |
|
|
159103 |
57260158 |
1 |
SCl2N2O2C19H26 |
AB2C2D2E19F26 |
-105.16 |
2.79 |
-9.05 |
-0.1 |
0 |
|
|
159104 |
57260160 |
1 |
SN3O4C16H21 |
AB3C4D16E21 |
-99.39 |
5.5 |
-9.52 |
-1.27 |
1 |
|
|
159105 |
57260207 |
1 |
SO2N4C10H15 |
AB2C4D10E15 |
18.76 |
3.88 |
0.0 |
0.0 |
0 |
|
|
159106 |
57260342 |
1 |
SiC19H22 |
AB19C22 |
35.91 |
0.76 |
-8.58 |
-0.24 |
1 |
|
|
159107 |
57260343 |
1 |
OCl2N2F6C36H37 |
AB2C2D6E36F37 |
-302.37 |
8.39 |
0.0 |
0.0 |
0 |
|
|
159108 |
57260389 |
1 |
FNC28H42 |
ABC28D42 |
-77.67 |
6.3 |
-9.91 |
-0.76 |
0 |
|
|
159109 |
57260390 |
1 |
ON3C24H29 |
AB3C24D29 |
-2.52 |
6.32 |
-7.91 |
-0.12 |
0 |
|
|
159110 |
57260391 |
1 |
OSN2C21H30 |
ABC2D21E30 |
-35.39 |
7.09 |
-8.59 |
-0.31 |
0 |
|
|
159111 |
57260392 |
1 |
O2N3C22H29 |
A2B3C22D29 |
-64.45 |
6.18 |
-8.26 |
-0.02 |
0 |
|
|
159112 |
57260395 |
1 |
NSO2C8H9 |
ABC2D8E9 |
-48.19 |
5.2 |
-8.98 |
-0.76 |
0 |
|
|
159113 |
57260398 |
1 |
SN4O5C25H36 |
AB4C5D25E36 |
-84.53 |
4.91 |
-8.75 |
-0.79 |
0 |
|
|
159114 |
57260399 |
1 |
SO2N5H31C32 |
AB2C5D31E32 |
81.03 |
7.1 |
-8.48 |
-0.78 |
0 |
|
|
159115 |
57260400 |
1 |
O2C5H6 |
A2B5C6 |
12.97 |
0.9 |
-8.98 |
-0.91 |
0 |
|
|
159116 |
57260401 |
1 |
SO8C13H18 |
AB8C13D18 |
-308.95 |
3.4 |
-9.3 |
-1.12 |
0 |
|
|
159117 |
57260455 |
2 |
OC6H13 |
AB6C13 |
-154.68 |
3.14 |
-10.11 |
2.42 |
0 |
|
|
159118 |
57260456 |
1 |
NPO3C11H14 |
ABC3D11E14 |
-141.06 |
8.58 |
-9.62 |
-0.6 |
0 |
|
|
159119 |
57260457 |
1 |
ION5H18C21 |
ABC5D18E21 |
124.84 |
3.61 |
-9.28 |
-1.0 |
0 |
|
|
159120 |
57260458 |
1 |
SN2O5H22C23 |
AB2C5D22E23 |
-147.52 |
4.59 |
-9.02 |
-1.34 |
0 |
|
|
159121 |
57260459 |
1 |
N2O3C26H36 |
A2B3C26D36 |
-86.84 |
0.74 |
-8.78 |
-1.02 |
0 |
|
|
159122 |
57260460 |
1 |
O3N6C21H32 |
A3B6C21D32 |
-85.47 |
7.5 |
-9.12 |
-0.74 |
0 |
|
|
159123 |
57260461 |
1 |
BSiN2H36C39 |
ABC2D36E39 |
897.19 |
5.51 |
0.0 |
0.0 |
0 |
|
|
159124 |
57260462 |
1 |
N2O5C24H28 |
A2B5C24D28 |
-166.27 |
1.52 |
-9.02 |
-0.84 |
0 |
|
|
159125 |
57260466 |
1 |
S3N9O10C18H25 |
A3B9C10D18E25 |
-328.36 |
10.31 |
-9.17 |
-1.22 |
0 |
|
|
159126 |
57260467 |
1 |
OC15H24 |
AB15C24 |
-69.1 |
2.12 |
-8.95 |
0.26 |
0 |
|
|
159127 |
57260468 |
1 |
Cl2N2O2C35H40 |
A2B2C2D35E40 |
-52.13 |
4.15 |
-8.76 |
-0.44 |
0 |
|
|
159128 |
57260469 |
2 |
N2O2C8H17 |
A2B2C8D17 |
-232.37 |
4.26 |
-9.2 |
0.71 |
0 |
|
|
159129 |
57260470 |
1 |
O5F6H16C21 |
A5B6C16D21 |
-454.53 |
1.82 |
-9.81 |
-1.06 |
0 |
|
|
159130 |
57260512 |
1 |
NC10H11 |
AB10C11 |
62.66 |
1.34 |
-8.01 |
-0.84 |
0 |
|
|
159131 |
57260513 |
1 |
ClNOSC16H16 |
ABCDE16F16 |
-6.66 |
6.52 |
-8.62 |
-0.86 |
0 |
|
|
159132 |
57260514 |
2 |
NOC6H6 |
ABC6D6 |
-18.92 |
1.65 |
-8.65 |
-0.17 |
0 |
|
|
159133 |
57260550 |
1 |
F3O4N5C29H34 |
A3B4C5D29E34 |
-284.02 |
2.66 |
-8.2 |
-0.98 |
0 |
|
|
159134 |
57260551 |
1 |
OSiS2C15H26 |
ABC2D15E26 |
-111.76 |
3.48 |
-8.89 |
-1.14 |
0 |
|
|
159135 |
57260768 |
1 |
OS2H24C30 |
AB2C24D30 |
77.06 |
4.69 |
-8.54 |
-1.92 |
0 |
|
|
159136 |
57260769 |
1 |
SN2O3F4H12C17 |
AB2C3D4E12F17 |
-255.92 |
2.87 |
-9.64 |
-1.46 |
0 |
|
|
159137 |
57260770 |
1 |
F2N4O5H10C16 |
A2B4C5D10E16 |
-130.07 |
3.09 |
-9.37 |
-1.88 |
0 |
|
|
159138 |
57260772 |
1 |
O6C15H16 |
A6B15C16 |
-245.09 |
0.33 |
-9.06 |
0.12 |
0 |
|
|
159139 |
57260822 |
1 |
Br2O3C5H6 |
A2B3C5D6 |
-126.08 |
4.26 |
-11.0 |
-1.22 |
0 |
|
|
159140 |
57260825 |
2 |
O2C7H12 |
A2B7C12 |
-198.12 |
3.0 |
-10.04 |
0.68 |
1 |
|
|
159141 |
57260826 |
1 |
N3O7C35H62 |
A3B7C35D62 |
-373.99 |
2.24 |
0.0 |
0.0 |
0 |
|
|
159142 |
57260827 |
1 |
F2N2O4C21H24 |
A2B2C4D21E24 |
-224.2 |
4.55 |
-10.13 |
-1.59 |
0 |
|
|
159143 |
57260893 |
1 |
N2F3O6H25C28 |
A2B3C6D25E28 |
-291.87 |
4.22 |
-9.29 |
-1.22 |
0 |
|
|
159144 |
57261060 |
1 |
ON4C18H18 |
AB4C18D18 |
68.69 |
4.09 |
-9.06 |
-1.81 |
1 |
|
|
159145 |
57261283 |
1 |
PC3O3H8 |
AB3C3D8 |
-138.62 |
3.8 |
0.0 |
0.0 |
0 |
|
|
159146 |
57261284 |
1 |
ClNO4C13H14 |
ABC4D13E14 |
-160.42 |
2.8 |
-9.47 |
-0.93 |
0 |
|
|
159147 |
57261286 |
1 |
NO3C15H23 |
AB3C15D23 |
-146.8 |
4.5 |
-8.97 |
0.11 |
0 |
|
|
159148 |
57261303 |
1 |
N3O4C13H15 |
A3B4C13D15 |
-93.07 |
3.44 |
-9.16 |
-1.69 |
0 |
|
|
159149 |
57261333 |
1 |
NSO3C8H13 |
ABC3D8E13 |
-128.89 |
7.27 |
-9.05 |
-0.6 |
0 |
|
|
159150 |
57261351 |
1 |
SO3N5C23H25 |
AB3C5D23E25 |
-36.37 |
4.23 |
-9.14 |
-1.1 |
0 |
|
|
159151 |
57261352 |
1 |
NF3H8C11 |
AB3C8D11 |
-87.71 |
0.99 |
-9.09 |
-1.03 |
0 |
|
|
159152 |
57261353 |
1 |
Br2O2S3H12C16 |
A2B2C3D12E16 |
36.72 |
5.77 |
-9.07 |
-1.31 |
0 |
|
|
159153 |
57261406 |
1 |
ON3H15C16 |
AB3C15D16 |
76.36 |
5.74 |
-8.92 |
-0.98 |
0 |
|
|
159154 |
57261635 |
1 |
N3O5C26H31 |
A3B5C26D31 |
-96.54 |
7.87 |
-9.44 |
-1.56 |
0 |
|
|
159155 |
57261709 |
1 |
N4O5H20C22 |
A4B5C20D22 |
-71.08 |
7.34 |
-8.91 |
-1.22 |
0 |
|
|
159156 |
57264261 |
1 |
SN5O5C26H33 |
AB5C5D26E33 |
-171.54 |
10.77 |
-9.19 |
-0.82 |
0 |
|
|
159157 |
57264265 |
3 |
NO2C10H13 |
AB2C10D13 |
-207.07 |
2.45 |
-8.66 |
0.2 |
0 |
|
|
159158 |
57264269 |
1 |
SN3C16H21 |
AB3C16D21 |
35.58 |
6.06 |
-8.8 |
-0.53 |
0 |
|
|
159159 |
57264271 |
1 |
OCl2N3H15C18 |
AB2C3D15E18 |
52.61 |
1.33 |
-9.68 |
-0.6 |
0 |
|
|
159160 |
57264272 |
1 |
SN2O5C23H32 |
AB2C5D23E32 |
-232.84 |
7.35 |
-9.3 |
-0.45 |
0 |
|
|
159161 |
57264275 |
1 |
I3N4O6C14H15 |
A3B4C6D14E15 |
-168.28 |
4.69 |
-10.11 |
-2.33 |
0 |
|
|
159162 |
57264276 |
1 |
OF2N2C28H30 |
AB2C2D28E30 |
-65.34 |
3.9 |
-9.65 |
-0.4 |
0 |
|
|
159163 |
57264277 |
1 |
ClO2N4C11H15 |
AB2C4D11E15 |
22.64 |
1.56 |
-9.64 |
-0.92 |
0 |
|
|
159164 |
57264278 |
2 |
SO4C8H12 |
AB4C8D12 |
-332.35 |
1.84 |
-8.33 |
0.03 |
0 |
|
|
159165 |
57264279 |
1 |
O6C21H26 |
A6B21C26 |
-234.93 |
6.64 |
-9.95 |
-0.97 |
0 |
|
|
159166 |
57264280 |
1 |
NO3C27H29 |
AB3C27D29 |
-88.1 |
4.98 |
-8.67 |
0.11 |
0 |
|
|
159167 |
57264281 |
1 |
S2N7O9C19H29 |
A2B7C9D19E29 |
-289.84 |
10.65 |
-8.91 |
-0.67 |
0 |
|
|
159168 |
57264286 |
2 |
NOH6C8 |
ABC6D8 |
28.13 |
2.74 |
-9.24 |
-1.09 |
0 |
|
|
159169 |
57264287 |
1 |
NOC10H19 |
ABC10D19 |
-68.56 |
3.19 |
-8.91 |
0.65 |
0 |
|
|
159170 |
57264288 |
1 |
ClNSO4H16C19 |
ABCD4E16F19 |
-92.76 |
4.74 |
-8.93 |
-0.94 |
0 |
|
|
159171 |
57264292 |
1 |
O2N3C24H33 |
A2B3C24D33 |
-72.0 |
3.7 |
-8.23 |
0.17 |
0 |
|
|
159172 |
57264296 |
1 |
BrOCl2F3N3H7C15 |
ABC2D3E3F7G15 |
-136.59 |
3.72 |
-9.16 |
-1.38 |
0 |
|
|
159173 |
57264299 |
1 |
N2O6C11H18 |
A2B6C11D18 |
-256.11 |
6.27 |
-10.48 |
-0.27 |
0 |
|
|
159174 |
57264322 |
1 |
NO4C8H15 |
AB4C8D15 |
-193.28 |
4.32 |
-10.16 |
0.23 |
0 |
|
|
159175 |
57264323 |
6 |
CH |
AB |
24.19 |
0.0 |
-9.64 |
0.38 |
0 |
|
|
159176 |
57264324 |
1 |
ON2C14H16 |
AB2C14D16 |
18.85 |
2.58 |
-9.04 |
-0.55 |
0 |
|
|
159177 |
57264325 |
1 |
BrPSN3O5C19H31 |
ABCD3E5F19G31 |
-216.49 |
5.48 |
-9.57 |
-1.26 |
0 |
|
|
159178 |
57264326 |
1 |
SN2O3C27H34 |
AB2C3D27E34 |
-57.99 |
2.35 |
-8.32 |
-0.9 |
0 |
|
|
159179 |
57264327 |
1 |
NO3C9H15 |
AB3C9D15 |
-83.11 |
4.25 |
-9.54 |
-0.18 |
0 |
|
|
159180 |
57264328 |
1 |
N2O2C7H18 |
A2B2C7D18 |
-125.63 |
2.88 |
-9.66 |
2.39 |
0 |
|
|
159181 |
57264331 |
1 |
NOC8H17 |
ABC8D17 |
-26.82 |
0.92 |
-9.15 |
0.79 |
0 |
|
|
159182 |
57264332 |
1 |
NO6C22H29 |
AB6C22D29 |
-247.77 |
4.57 |
-9.68 |
-0.93 |
0 |
|
|
159183 |
57264336 |
3 |
FOC5H5 |
ABC5D5 |
-222.65 |
6.48 |
-9.41 |
-0.53 |
0 |
|
|
159184 |
57264341 |
2 |
O2C10H11 |
A2B10C11 |
-147.89 |
5.58 |
-9.31 |
-0.42 |
0 |
|
|
159185 |
57264342 |
1 |
ON3C15H15 |
AB3C15D15 |
33.83 |
2.42 |
-8.84 |
-0.01 |
0 |
|
|
159186 |
57264343 |
1 |
NO3C18H33 |
AB3C18D33 |
-193.34 |
7.05 |
-9.79 |
0.42 |
0 |
|
|
159187 |
57264345 |
1 |
N3O4C7H15 |
A3B4C7D15 |
-168.03 |
5.6 |
-9.37 |
-0.2 |
0 |
|
|
159188 |
57264347 |
1 |
N5C11H15 |
A5B11C15 |
88.02 |
9.16 |
-10.3 |
-0.55 |
1 |
|
|
159189 |
57264348 |
1 |
ClO2N5C24H33 |
AB2C5D24E33 |
-40.75 |
5.13 |
0.0 |
0.0 |
0 |
|
|
159190 |
57264354 |
1 |
N3O5C20H27 |
A3B5C20D27 |
-150.83 |
4.28 |
-8.41 |
-0.22 |
0 |
|
|
159191 |
57264355 |
1 |
O4C17H28 |
A4B17C28 |
-202.18 |
1.55 |
-10.46 |
-0.19 |
0 |