List Systems
Back
Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
375343 |
131500019 |
1 |
BrNO3H8C10 |
ABC3D8E10 |
-53.1 |
4.51 |
-9.71 |
-1.01 |
0 |
|
|
375344 |
131500022 |
1 |
BrNO3H8C10 |
ABC3D8E10 |
-60.97 |
2.97 |
-9.86 |
-1.28 |
0 |
|
|
375345 |
131500025 |
1 |
BrClOC12H14 |
ABCD12E14 |
-46.97 |
3.92 |
-9.77 |
-0.88 |
0 |
|
|
375346 |
131500036 |
1 |
BrOC12H15 |
ABC12D15 |
-43.71 |
4.45 |
-9.28 |
-0.05 |
0 |
|
|
375347 |
131500039 |
1 |
BrOC12H15 |
ABC12D15 |
-45.95 |
3.1 |
-9.38 |
-0.73 |
0 |
|
|
375348 |
131500048 |
1 |
NO2C12H17 |
AB2C12D17 |
-74.79 |
3.03 |
-8.48 |
0.42 |
0 |
|
|
375349 |
131500050 |
1 |
BrNO2C11H12 |
ABC2D11E12 |
-68.48 |
5.94 |
-9.72 |
-0.8 |
0 |
|
|
375350 |
131500057 |
1 |
N2O3C10H12 |
A2B3C10D12 |
-92.08 |
4.87 |
-8.66 |
-0.32 |
0 |
|
|
375351 |
131500061 |
2 |
NOC5H6 |
ABC5D6 |
-37.12 |
3.33 |
-9.95 |
-0.8 |
0 |
|
|
375352 |
131500062 |
2 |
NOC5H6 |
ABC5D6 |
-40.05 |
3.73 |
-9.83 |
-0.58 |
0 |
|
|
375353 |
131500064 |
1 |
NO4C9H13 |
AB4C9D13 |
-155.89 |
3.03 |
-8.85 |
-0.18 |
0 |
|
|
375354 |
131500065 |
1 |
ON4C10H10 |
AB4C10D10 |
60.08 |
5.82 |
-9.73 |
-1.11 |
0 |
|
|
375355 |
131500067 |
1 |
ClNO3C9H12 |
ABC3D9E12 |
-121.98 |
3.26 |
-9.1 |
-0.27 |
0 |
|
|
375356 |
131500070 |
1 |
N2O3C9H10 |
A2B3C9D10 |
-59.03 |
6.45 |
-10.38 |
-0.76 |
0 |
|
|
375357 |
131500072 |
1 |
NO5C9H9 |
AB5C9D9 |
-99.22 |
3.12 |
-9.42 |
-1.64 |
0 |
|
|
375358 |
131500075 |
1 |
NO5H7C10 |
AB5C7D10 |
-80.89 |
2.96 |
-10.26 |
-2.2 |
0 |
|
|
375359 |
131500076 |
1 |
NOSC11H13 |
ABCD11E13 |
-5.39 |
5.47 |
-8.57 |
-0.85 |
0 |
|
|
375360 |
131500079 |
1 |
NOSC11H13 |
ABCD11E13 |
-6.09 |
2.06 |
-8.27 |
0.22 |
0 |
|
|
375361 |
131500082 |
1 |
N3H9C10 |
A3B9C10 |
64.46 |
3.87 |
-8.42 |
-0.63 |
0 |
|
|
375362 |
131500086 |
1 |
NSF3C10H10 |
ABC3D10E10 |
-125.06 |
3.32 |
-9.57 |
-1.22 |
0 |
|
|
375363 |
131500087 |
1 |
NOF2C11H13 |
ABC2D11E13 |
-116.66 |
4.47 |
-9.01 |
-0.48 |
0 |
|
|
375364 |
131500100 |
1 |
BrN2O3C9H11 |
AB2C3D9E11 |
-101.48 |
1.81 |
-10.11 |
-1.6 |
0 |
|
|
375365 |
131500101 |
1 |
NO3C11H15 |
AB3C11D15 |
-119.31 |
1.88 |
-8.96 |
0.07 |
0 |
|
|
375366 |
131500102 |
1 |
ClNC13H18 |
ABC13D18 |
-1.0 |
1.65 |
-9.18 |
0.01 |
0 |
|
|
375367 |
131500110 |
2 |
NOF2H2C4 |
ABC2D2E4 |
-220.47 |
5.32 |
-10.28 |
-1.51 |
0 |
|
|
375368 |
131500112 |
2 |
NOF2H2C4 |
ABC2D2E4 |
-226.13 |
4.99 |
-9.99 |
-1.34 |
0 |
|
|
375369 |
131500115 |
2 |
NOF2H2C4 |
ABC2D2E4 |
-239.62 |
3.55 |
-9.96 |
-1.32 |
0 |
|
|
375370 |
131500120 |
2 |
NOF2H2C4 |
ABC2D2E4 |
-225.21 |
4.63 |
-9.98 |
-1.42 |
0 |
|
|
375371 |
131500121 |
2 |
NOF2H2C4 |
ABC2D2E4 |
-226.62 |
5.33 |
-9.85 |
-1.41 |
0 |
|
|
375372 |
131500124 |
2 |
NOF2H2C4 |
ABC2D2E4 |
-233.8 |
2.97 |
-10.0 |
-1.55 |
0 |
|
|
375373 |
131500125 |
1 |
BrClNSO2F3H4C7 |
ABCDE2F3G4H7 |
-212.09 |
9.38 |
-9.58 |
-1.63 |
0 |
|
|
375374 |
131500132 |
1 |
ON4C9H12 |
AB4C9D12 |
61.95 |
6.03 |
-8.59 |
-0.9 |
0 |
|
|
375375 |
131500133 |
1 |
ON4C9H12 |
AB4C9D12 |
44.19 |
2.78 |
-9.48 |
-0.73 |
0 |
|
|
375376 |
131500136 |
1 |
ON4C9H12 |
AB4C9D12 |
47.23 |
4.37 |
-9.25 |
-0.85 |
0 |
|
|
375377 |
131500142 |
1 |
BrFNSH7C11 |
ABCDE7F11 |
18.18 |
2.69 |
-9.1 |
-1.3 |
0 |
|
|
375378 |
131500143 |
1 |
BrFNSH7C11 |
ABCDE7F11 |
16.93 |
3.02 |
-9.13 |
-1.36 |
0 |
|
|
375379 |
131500144 |
1 |
BrFNSH7C11 |
ABCDE7F11 |
17.16 |
3.28 |
-9.02 |
-1.3 |
0 |
|
|
375380 |
131500145 |
1 |
BrFNSH7C11 |
ABCDE7F11 |
17.13 |
3.68 |
-8.99 |
-1.23 |
0 |
|
|
375381 |
131500146 |
1 |
BrFNSH7C11 |
ABCDE7F11 |
17.05 |
3.55 |
-9.08 |
-1.33 |
0 |
|
|
375382 |
131500148 |
1 |
O2N5C9H15 |
A2B5C9D15 |
-30.35 |
3.85 |
-9.64 |
0.15 |
0 |
|
|
375383 |
131500151 |
1 |
BrSO3H9C11 |
ABC3D9E11 |
-91.95 |
3.42 |
-8.8 |
-1.39 |
0 |
|
|
375384 |
131500155 |
1 |
NO2C12H19 |
AB2C12D19 |
-98.2 |
3.09 |
-9.08 |
0.18 |
0 |
|
|
375385 |
131500161 |
1 |
ON3C10H11 |
AB3C10D11 |
19.55 |
3.9 |
-9.01 |
-0.42 |
0 |
|
|
375386 |
131500165 |
1 |
N2O3C10H14 |
A2B3C10D14 |
-53.61 |
5.4 |
-9.32 |
-1.5 |
0 |
|
|
375387 |
131500172 |
1 |
INOC12H16 |
ABCD12E16 |
-9.45 |
0.9 |
-8.83 |
-0.64 |
0 |
|
|
375388 |
131500173 |
1 |
ON3C10H11 |
AB3C10D11 |
12.11 |
8.46 |
-8.88 |
-1.25 |
0 |
|
|
375389 |
131500174 |
1 |
BrOF2N2C9H11 |
ABC2D2E9F11 |
-133.38 |
1.31 |
-8.66 |
-0.11 |
0 |
|
|
375390 |
131500175 |
1 |
ON3C10H11 |
AB3C10D11 |
37.3 |
5.68 |
-8.72 |
-0.94 |
0 |
|
|
375391 |
131500180 |
1 |
NOSC12H19 |
ABCD12E19 |
-46.43 |
1.61 |
-8.4 |
0.0 |
0 |
|
|
375392 |
131500181 |
1 |
NOC13H19 |
ABC13D19 |
-42.97 |
1.88 |
-8.99 |
0.3 |
0 |