List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
341209 |
127263644 |
1 |
N2O3C12H22 |
A2B3C12D22 |
-143.43 |
4.87 |
-9.12 |
0.7 |
0 |
|
|
341210 |
127263645 |
1 |
N2O3C14H24 |
A2B3C14D24 |
-122.19 |
1.99 |
-9.13 |
0.71 |
0 |
|
|
341211 |
127263646 |
1 |
ON2F3H5C9 |
AB2C3D5E9 |
-156.41 |
0.73 |
-9.76 |
-1.88 |
0 |
|
|
341212 |
127263647 |
1 |
ClN2F3H4C9 |
AB2C3D4E9 |
-104.99 |
2.83 |
-10.26 |
-1.83 |
0 |
|
|
341213 |
127263648 |
1 |
N2F3H7C9 |
A2B3C7D9 |
-124.72 |
5.29 |
-8.43 |
-0.58 |
0 |
|
|
341214 |
127263649 |
1 |
NO2F5C9H12 |
AB2C5D9E12 |
-325.35 |
3.85 |
-9.56 |
-0.22 |
0 |
|
|
341215 |
127263650 |
1 |
FNO4C8H8 |
ABC4D8E8 |
-164.52 |
3.93 |
-9.65 |
-1.26 |
0 |
|
|
341216 |
127263651 |
1 |
BClFNO3C6H6 |
ABCDE3F6G6 |
-212.05 |
3.1 |
-9.73 |
-0.91 |
0 |
|
|
341217 |
127263652 |
1 |
ClFNO2H5C6 |
ABCD2E5F6 |
-95.95 |
4.93 |
-9.51 |
-0.95 |
0 |
|
|
341218 |
127263653 |
1 |
ClFNO2C7H7 |
ABCD2E7F7 |
-92.18 |
5.83 |
-9.32 |
-0.8 |
0 |
|
|
341219 |
127263654 |
1 |
ClFNO4H7C8 |
ABCD4E7F8 |
-169.89 |
7.88 |
-9.61 |
-1.58 |
0 |
|
|
341220 |
127263655 |
1 |
ClFNO3H7C8 |
ABCD3E7F8 |
-115.22 |
4.75 |
-9.5 |
-1.29 |
0 |
|
|
341221 |
127263656 |
1 |
FNO3C8H8 |
ABC3D8E8 |
-106.53 |
6.35 |
-9.4 |
-1.28 |
0 |
|
|
341222 |
127263657 |
1 |
ClFNO2H5C7 |
ABCD2E5F7 |
-78.0 |
5.07 |
-9.72 |
-1.57 |
0 |
|
|
341223 |
127263658 |
1 |
ClFNOH5C6 |
ABCDE5F6 |
-52.93 |
1.63 |
-9.55 |
-0.77 |
0 |
|
|
341224 |
127263659 |
1 |
ClFNO3H5C7 |
ABCD3E5F7 |
-132.68 |
5.07 |
-10.02 |
-1.64 |
0 |
|
|
341225 |
127263660 |
1 |
ClFNO2H5C7 |
ABCD2E5F7 |
-86.61 |
5.46 |
-10.14 |
-1.4 |
0 |
|
|
341226 |
127263661 |
1 |
ClNOF3C9H11 |
ABCD3E9F11 |
-217.34 |
4.11 |
-9.3 |
-0.27 |
0 |
|
|
341227 |
127263662 |
1 |
ClNSF3C9H11 |
ABCD3E9F11 |
-171.19 |
2.05 |
-8.88 |
-0.59 |
0 |
|
|
341228 |
127263663 |
1 |
ClNSF3C9H11 |
ABCD3E9F11 |
-173.73 |
5.15 |
-9.21 |
-0.85 |
0 |
|
|
341229 |
127263664 |
1 |
ClNF5H7C8 |
ABC5D7E8 |
-267.96 |
2.42 |
-10.35 |
-0.93 |
0 |
|
|
341230 |
127263665 |
1 |
ClNF3C9H11 |
ABC3D9E11 |
-185.7 |
1.74 |
-9.75 |
-0.33 |
0 |
|
|
341231 |
127263666 |
1 |
ClNF3C9H11 |
ABC3D9E11 |
-180.9 |
1.86 |
-9.47 |
0.03 |
0 |
|
|
341232 |
127263667 |
1 |
ClN2F3C7H8 |
AB2C3D7E8 |
-164.66 |
3.6 |
-10.66 |
-1.14 |
0 |
|
|
341233 |
127263668 |
1 |
ClN2F3C7H8 |
AB2C3D7E8 |
-161.8 |
2.67 |
-10.3 |
-0.42 |
0 |
|
|
341234 |
127263669 |
1 |
ClN2F3C7H8 |
AB2C3D7E8 |
-164.76 |
4.05 |
-10.49 |
-0.8 |
0 |
|
|
341235 |
127263670 |
1 |
BrOSN2H7C8 |
ABCD2E7F8 |
-1.85 |
3.72 |
-9.24 |
-0.97 |
0 |
|
|
341236 |
127263671 |
1 |
OH5F9C11 |
AB5C9D11 |
-497.78 |
2.64 |
-11.47 |
-1.94 |
0 |
|
|
341237 |
127263672 |
1 |
ON2C9H10 |
AB2C9D10 |
-16.14 |
3.67 |
-10.12 |
-0.44 |
0 |
|
|
341238 |
127263673 |
1 |
ClN4C8H9 |
AB4C8D9 |
59.64 |
6.47 |
-9.79 |
-1.17 |
0 |
|
|
341239 |
127263674 |
1 |
ClF3H4N4C7 |
AB3C4D4E7 |
-84.48 |
5.01 |
-10.16 |
-1.48 |
0 |
|
|
341240 |
127263675 |
1 |
Cl2F3H3N4C7 |
A2B3C3D4E7 |
-86.59 |
5.88 |
-10.04 |
-1.66 |
0 |
|
|
341241 |
127263676 |
1 |
ClON2C6H15 |
ABC2D6E15 |
-92.79 |
4.9 |
-9.03 |
1.52 |
0 |
|
|
341242 |
127263677 |
1 |
ClON2C6H15 |
ABC2D6E15 |
-93.59 |
3.1 |
-9.2 |
1.44 |
0 |
|
|
341243 |
127263678 |
1 |
BO5C15H19 |
AB5C15D19 |
-264.75 |
4.09 |
-10.02 |
-1.12 |
0 |
|
|
341244 |
127263679 |
1 |
BF3O4C14H16 |
AB3C4D14E16 |
-386.09 |
6.02 |
-9.82 |
-0.84 |
0 |
|
|
341245 |
127263680 |
1 |
BBrO3C13H16 |
ABC3D13E16 |
-178.75 |
7.05 |
-9.65 |
-0.82 |
0 |
|
|
341246 |
127263681 |
1 |
BBrO3C13H16 |
ABC3D13E16 |
-177.01 |
5.99 |
-9.59 |
-0.47 |
0 |
|
|
341247 |
127263682 |
1 |
BO5C15H21 |
AB5C15D21 |
-255.29 |
2.96 |
-8.74 |
-0.26 |
0 |
|
|
341248 |
127263683 |
1 |
BO5C15H21 |
AB5C15D21 |
-255.39 |
2.54 |
-8.28 |
-0.16 |
0 |
|
|
341249 |
127263684 |
1 |
BO3C15H21 |
AB3C15D21 |
-199.63 |
5.25 |
-9.19 |
-0.33 |
0 |
|
|
341250 |
127263685 |
1 |
BO3C15H21 |
AB3C15D21 |
-193.8 |
4.95 |
-9.4 |
-0.38 |
0 |
|
|
341251 |
127263686 |
1 |
BNO3C14H16 |
ABC3D14E16 |
-146.91 |
1.37 |
-10.24 |
-1.22 |
0 |
|
|
341252 |
127263687 |
1 |
BBrO3C13H16 |
ABC3D13E16 |
-177.76 |
5.22 |
-9.77 |
-0.84 |
0 |
|
|
341253 |
127263688 |
1 |
BO3C14H19 |
AB3C14D19 |
-189.98 |
3.91 |
-9.44 |
-0.4 |
0 |
|
|
341254 |
127263689 |
1 |
BO3C14H19 |
AB3C14D19 |
-189.7 |
4.48 |
-9.39 |
-0.48 |
0 |
|
|
341255 |
127263690 |
1 |
BO4C14H19 |
AB4C14D19 |
-219.99 |
7.7 |
-8.91 |
-0.57 |
0 |
|
|
341256 |
127263691 |
1 |
FNO2H4C5 |
ABC2D4E5 |
-103.43 |
4.36 |
-10.16 |
-0.68 |
0 |
|
|
341257 |
127263692 |
1 |
FNO2C6H6 |
ABC2D6E6 |
-103.92 |
1.82 |
-9.8 |
-0.4 |
0 |
|
|
341258 |
127263693 |
1 |
FNO2C7H8 |
ABC2D7E8 |
-105.57 |
2.56 |
-9.57 |
-0.22 |
0 |