List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
186201 |
77403027 |
1 |
O3C23H30 |
A3B23C30 |
-135.83 |
3.18 |
-8.74 |
-0.16 |
0 |
|
|
186202 |
77403114 |
1 |
O4C19H22 |
A4B19C22 |
-98.19 |
6.14 |
-8.33 |
-0.03 |
0 |
|
|
186203 |
77403115 |
1 |
SO3C20H22 |
AB3C20D22 |
-63.24 |
2.94 |
-8.73 |
-0.38 |
0 |
|
|
186204 |
77403116 |
1 |
O5C22H28 |
A5B22C28 |
-200.15 |
4.71 |
-8.59 |
-0.24 |
0 |
|
|
186205 |
77403838 |
1 |
FN4O6H17C23 |
AB4C6D17E23 |
-184.25 |
7.62 |
-9.24 |
-1.37 |
0 |
|
|
186206 |
77404979 |
1 |
ClFNO4H29C30 |
ABCD4E29F30 |
-169.82 |
7.33 |
-8.62 |
-0.7 |
0 |
|
|
186207 |
77405000 |
1 |
FNO4C25H26 |
ABC4D25E26 |
-182.8 |
8.46 |
-9.24 |
-0.99 |
0 |
|
|
186208 |
77405071 |
1 |
NO4C31H37 |
AB4C31D37 |
-149.76 |
4.32 |
-8.24 |
-0.25 |
0 |
|
|
186209 |
77405399 |
1 |
FNOC24H30 |
ABCD24E30 |
77.62 |
2.23 |
-9.02 |
0.68 |
0 |
|
|
186210 |
77405400 |
1 |
NOC26H31 |
ABC26D31 |
2.93 |
5.77 |
-9.72 |
-0.21 |
0 |
|
|
186211 |
77405401 |
2 |
NOC13H17 |
ABC13D17 |
-80.43 |
6.04 |
-8.86 |
-0.43 |
0 |
|
|
186212 |
77405402 |
1 |
FNOC24H30 |
ABCD24E30 |
127.89 |
6.35 |
-7.55 |
-0.03 |
0 |
|
|
186213 |
77405403 |
1 |
ClNOC24H30 |
ABCD24E30 |
108.63 |
2.44 |
-8.62 |
-0.69 |
0 |
|
|
186214 |
77405404 |
1 |
ON2C24H32 |
AB2C24D32 |
89.46 |
3.14 |
-7.16 |
0.86 |
0 |
|
|
186215 |
77405405 |
1 |
FNOC24H30 |
ABCD24E30 |
73.68 |
3.33 |
-8.82 |
-0.07 |
0 |
|
|
186216 |
77405406 |
1 |
SN2F3O3C25H31 |
AB2C3D3E25F31 |
-54.62 |
3.55 |
-8.15 |
-1.21 |
0 |
|
|
186217 |
77405407 |
1 |
ON2C25H30 |
AB2C25D30 |
165.32 |
6.24 |
-6.46 |
-0.66 |
0 |
|
|
186218 |
77405408 |
1 |
NOF2C25H31 |
ABC2D25E31 |
128.1 |
2.54 |
-5.63 |
-2.06 |
0 |
|
|
186219 |
77405409 |
1 |
FNOC25H32 |
ABCD25E32 |
-85.0 |
5.62 |
-9.34 |
-0.37 |
0 |
|
|
186220 |
77405452 |
1 |
ON2C25H34 |
AB2C25D34 |
-32.45 |
2.42 |
-9.47 |
-0.18 |
0 |
|
|
186221 |
77405453 |
1 |
ClNC25H34 |
ABC25D34 |
-6.67 |
1.91 |
-9.47 |
-0.41 |
0 |
|
|
186222 |
77405454 |
1 |
NO2C28H39 |
AB2C28D39 |
-94.44 |
3.6 |
-9.1 |
-0.22 |
0 |
|
|
186223 |
77405455 |
1 |
INOC19H26 |
ABCD19E26 |
-39.43 |
4.51 |
-9.46 |
-0.69 |
0 |
|
|
186224 |
77405456 |
1 |
ON2C22H32 |
AB2C22D32 |
-50.5 |
3.39 |
-9.09 |
-0.08 |
0 |
|
|
186225 |
77405576 |
1 |
ON4C21H28 |
AB4C21D28 |
10.36 |
5.14 |
-9.04 |
-0.78 |
0 |
|
|
186226 |
77405577 |
2 |
NOC12H16 |
ABC12D16 |
-72.94 |
3.75 |
-8.71 |
-0.43 |
0 |
|
|
186227 |
77405578 |
1 |
INO2C19H28 |
ABC2D19E28 |
-102.01 |
4.28 |
-9.4 |
-0.67 |
0 |
|
|
186228 |
77405579 |
1 |
NO3C21H31 |
AB3C21D31 |
-149.4 |
6.01 |
-9.09 |
0.18 |
0 |
|
|
186229 |
77405580 |
1 |
FON4C15H23 |
ABC4D15E23 |
-64.49 |
3.92 |
-8.45 |
0.17 |
0 |
|
|
186230 |
77406125 |
1 |
O6N7C39H55 |
A6B7C39D55 |
-200.16 |
6.15 |
-8.84 |
-1.02 |
0 |
|
|
186231 |
77406161 |
1 |
OCl2N5H19C21 |
AB2C5D19E21 |
59.88 |
3.57 |
-8.67 |
-1.08 |
0 |
|
|
186232 |
77406162 |
1 |
SN4O6C21H26 |
AB4C6D21E26 |
-187.24 |
7.44 |
-9.39 |
-0.55 |
0 |
|
|
186233 |
77406163 |
1 |
OCl2N4H20C22 |
AB2C4D20E22 |
44.31 |
3.26 |
-8.91 |
-1.23 |
0 |
|
|
186234 |
77406409 |
1 |
N5O7C29H45 |
A5B7C29D45 |
-319.47 |
9.51 |
-9.48 |
-0.12 |
0 |
|
|
186235 |
77406638 |
1 |
O3N7C41H47 |
A3B7C41D47 |
-16.06 |
7.17 |
-8.62 |
-0.72 |
0 |
|
|
186236 |
77406639 |
1 |
BO3N4C27H33 |
AB3C4D27E33 |
-142.23 |
8.46 |
-8.96 |
-0.39 |
0 |
|
|
186237 |
77407730 |
1 |
NO2C14H17 |
AB2C14D17 |
17.11 |
9.23 |
-9.19 |
-1.24 |
0 |
|
|
186238 |
77408662 |
1 |
ClN2O2C22H39 |
AB2C2D22E39 |
-157.38 |
4.44 |
-8.98 |
0.82 |
0 |
|
|
186239 |
77409018 |
1 |
O7C26H26 |
A7B26C26 |
-225.59 |
9.7 |
-9.2 |
-0.89 |
0 |
|
|
186240 |
77409019 |
1 |
O7C29H32 |
A7B29C32 |
-243.34 |
6.65 |
-9.19 |
-0.97 |
0 |
|
|
186241 |
77409020 |
1 |
O7C31H36 |
A7B31C36 |
-253.72 |
10.44 |
-9.14 |
-0.88 |
0 |
|
|
186242 |
77410133 |
1 |
OF2N5C19H21 |
AB2C5D19E21 |
-22.81 |
4.63 |
-8.86 |
-1.02 |
0 |
|
|
186243 |
77410436 |
1 |
ClFN3O3H25C27 |
ABC3D3E25F27 |
-73.62 |
7.41 |
-9.55 |
-0.47 |
0 |
|
|
186244 |
77411001 |
1 |
N3O3C25H31 |
A3B3C25D31 |
-84.41 |
3.6 |
-9.11 |
-0.16 |
0 |
|
|
186245 |
77411002 |
1 |
F2N4O9C42H48 |
A2B4C9D42E48 |
-368.43 |
4.14 |
-8.57 |
-0.78 |
0 |
|
|
186246 |
77411404 |
1 |
ON6C22H24 |
AB6C22D24 |
50.89 |
3.45 |
-8.58 |
-0.38 |
0 |
|
|
186247 |
77411480 |
1 |
Cl2N3O6C32H33 |
A2B3C6D32E33 |
-143.64 |
3.12 |
-8.94 |
-0.64 |
0 |
|
|
186248 |
77411481 |
1 |
O4N7C29H31 |
A4B7C29D31 |
-30.94 |
6.76 |
-8.57 |
-0.61 |
0 |
|
|
186249 |
77411540 |
1 |
F3O4N7C23H32 |
A3B4C7D23E32 |
-316.53 |
5.89 |
-8.81 |
-0.58 |
0 |
|
|
186250 |
77411541 |
1 |
FN2O9C42H65 |
AB2C9D42E65 |
-511.41 |
7.46 |
-9.36 |
-0.28 |
0 |