List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
291850 |
113585051 |
1 |
BrClOF3N3H8C9 |
ABCD3E3F8G9 |
-157.42 |
6.15 |
-9.52 |
-1.12 |
0 |
|
|
291851 |
113585055 |
1 |
OBr2N3C12H15 |
AB2C3D12E15 |
20.1 |
2.3 |
-9.29 |
-1.2 |
0 |
|
|
291852 |
113585058 |
1 |
OBr2N3C11H13 |
AB2C3D11E13 |
27.12 |
3.29 |
-9.33 |
-0.88 |
0 |
|
|
291853 |
113585059 |
1 |
BrClN3O3C10H11 |
ABC3D3E10F11 |
-73.37 |
4.64 |
-9.35 |
-1.09 |
0 |
|
|
291854 |
113585064 |
1 |
ClON3C13H20 |
ABC3D13E20 |
-26.12 |
5.22 |
-8.77 |
-0.45 |
0 |
|
|
291855 |
113585065 |
1 |
ClON3C12H18 |
ABC3D12E18 |
-15.44 |
5.04 |
-8.86 |
-0.53 |
0 |
|
|
291856 |
113585070 |
1 |
BrOSN3C12H20 |
ABCD3E12F20 |
-25.53 |
5.9 |
-8.91 |
-0.83 |
0 |
|
|
291857 |
113585071 |
1 |
ClOSN3C12H18 |
ABCD3E12F18 |
-5.51 |
2.33 |
-8.46 |
-0.67 |
0 |
|
|
291858 |
113585080 |
1 |
BrON3C12H18 |
ABC3D12E18 |
-12.14 |
5.88 |
-8.99 |
-0.48 |
0 |
|
|
291859 |
113585090 |
1 |
ClON3C12H14 |
ABC3D12E14 |
46.15 |
2.46 |
-8.49 |
-0.63 |
0 |
|
|
291860 |
113585094 |
1 |
ClO2N3C12H18 |
AB2C3D12E18 |
-51.29 |
6.78 |
-8.8 |
-0.39 |
0 |
|
|
291861 |
113585100 |
1 |
BrON3C12H16 |
ABC3D12E16 |
28.22 |
6.65 |
-8.99 |
-0.5 |
0 |
|
|
291862 |
113585105 |
1 |
BrON3C12H20 |
ABC3D12E20 |
-35.51 |
4.64 |
-9.3 |
-0.8 |
0 |
|
|
291863 |
113585106 |
1 |
ClON3C13H22 |
ABC3D13E22 |
-51.62 |
5.67 |
-8.7 |
-0.31 |
0 |
|
|
291864 |
113585107 |
1 |
BrON3C13H22 |
ABC3D13E22 |
-38.09 |
4.33 |
-9.32 |
-0.87 |
0 |
|
|
291865 |
113585108 |
1 |
ClON3C13H18 |
ABC3D13E18 |
12.24 |
1.8 |
-8.8 |
-0.84 |
0 |
|
|
291866 |
113585109 |
1 |
BrON3C13H22 |
ABC3D13E22 |
-40.65 |
4.83 |
-9.21 |
-0.77 |
0 |
|
|
291867 |
113585110 |
1 |
ClOSN3C12H18 |
ABCD3E12F18 |
-4.91 |
1.3 |
-8.58 |
-0.72 |
0 |
|
|
291868 |
113585111 |
1 |
BrOSN3C11H16 |
ABCD3E11F16 |
8.38 |
3.77 |
-8.87 |
-0.7 |
0 |
|
|
291869 |
113585112 |
1 |
BrOSN3C11H18 |
ABCD3E11F18 |
-25.63 |
6.98 |
-8.97 |
-0.48 |
0 |
|
|
291870 |
113585113 |
1 |
BrOSN3C12H18 |
ABCD3E12F18 |
3.77 |
3.72 |
-8.97 |
-0.56 |
0 |
|
|
291871 |
113585114 |
1 |
BrSO2N3C11H18 |
ABC2D3E11F18 |
-55.88 |
7.5 |
-8.91 |
-0.5 |
0 |
|
|
291872 |
113585122 |
1 |
ClO2N3C12H18 |
AB2C3D12E18 |
-54.8 |
6.54 |
-8.95 |
-0.69 |
0 |
|
|
291873 |
113585123 |
1 |
ClON3C13H18 |
ABC3D13E18 |
-17.57 |
5.25 |
-8.92 |
-0.58 |
0 |
|
|
291874 |
113585124 |
1 |
BrON3C12H12 |
ABC3D12E12 |
53.63 |
5.66 |
-9.15 |
-0.68 |
0 |
|
|
291875 |
113585125 |
1 |
ClON3C12H14 |
ABC3D12E14 |
20.51 |
4.72 |
-8.96 |
-0.68 |
0 |
|
|
291876 |
113585132 |
1 |
ClO2N3C12H18 |
AB2C3D12E18 |
-51.9 |
6.6 |
-8.78 |
-0.49 |
0 |
|
|
291877 |
113585136 |
1 |
BrSO2N3C11H18 |
ABC2D3E11F18 |
-61.05 |
3.89 |
-8.67 |
-1.02 |
0 |
|
|
291878 |
113585145 |
1 |
BrON3C12H14 |
ABC3D12E14 |
50.19 |
3.97 |
-9.26 |
-0.86 |
0 |
|
|
291879 |
113585157 |
1 |
BrOSN3C12H16 |
ABCD3E12F16 |
39.86 |
4.71 |
-9.02 |
-0.69 |
0 |
|
|
291880 |
113585158 |
1 |
BrOSN3C12H20 |
ABCD3E12F20 |
-30.11 |
4.76 |
-9.0 |
-0.64 |
0 |
|
|
291881 |
113585160 |
1 |
BrOSN3C12H20 |
ABCD3E12F20 |
-33.19 |
4.57 |
-8.98 |
-0.58 |
0 |
|
|
291882 |
113585161 |
1 |
ClSO2N3C11H16 |
ABC2D3E11F16 |
-24.82 |
5.59 |
-8.23 |
-0.45 |
0 |
|
|
291883 |
113585166 |
1 |
BrSO2N3C10H16 |
ABC2D3E10F16 |
-48.9 |
9.28 |
-8.81 |
-0.38 |
0 |
|
|
291884 |
113585167 |
1 |
ClSO2N3C11H16 |
ABC2D3E11F16 |
-53.65 |
1.39 |
-8.79 |
-0.7 |
0 |
|
|
291885 |
113585169 |
1 |
BrON4C12H19 |
ABC4D12E19 |
3.91 |
5.17 |
-8.78 |
-0.54 |
0 |
|
|
291886 |
113585170 |
1 |
ClON3C13H18 |
ABC3D13E18 |
1.25 |
1.91 |
-8.84 |
-0.88 |
0 |
|
|
291887 |
113585172 |
1 |
ClON4C12H19 |
ABC4D12E19 |
1.13 |
4.09 |
-8.78 |
-0.6 |
0 |
|
|
291888 |
113585174 |
1 |
BrO2N3C12H16 |
AB2C3D12E16 |
-37.92 |
4.62 |
-9.17 |
-0.66 |
0 |
|
|
291889 |
113585175 |
1 |
ClO2N3C12H18 |
AB2C3D12E18 |
-76.5 |
4.73 |
-8.94 |
-0.56 |
0 |
|
|
291890 |
113585178 |
1 |
BrN3O3C11H16 |
AB3C3D11E16 |
-103.19 |
6.95 |
-9.37 |
-0.88 |
0 |
|
|
291891 |
113585180 |
1 |
BrO2N3C11H16 |
AB2C3D11E16 |
-54.54 |
5.31 |
-9.35 |
-0.95 |
0 |
|
|
291892 |
113585181 |
1 |
ClN3O3C11H16 |
AB3C3D11E16 |
-110.05 |
6.81 |
-9.21 |
-0.88 |
0 |
|
|
291893 |
113635230 |
1 |
ON3C14H29 |
AB3C14D29 |
-60.34 |
2.24 |
-8.57 |
2.12 |
0 |
|
|
291894 |
113635231 |
1 |
N2O2C13H24 |
A2B2C13D24 |
-100.87 |
0.57 |
-8.68 |
1.78 |
0 |
|
|
291895 |
113635233 |
1 |
BrN4C13H23 |
AB4C13D23 |
16.42 |
2.65 |
-8.86 |
0.21 |
0 |
|
|
291896 |
113635234 |
1 |
N2O2C13H24 |
A2B2C13D24 |
-96.71 |
2.9 |
-8.72 |
1.94 |
0 |
|
|
291897 |
113635235 |
1 |
FON3C13H18 |
ABC3D13E18 |
-66.55 |
2.65 |
-8.91 |
-0.16 |
0 |
|
|
291898 |
113635236 |
1 |
O2N4C11H20 |
A2B4C11D20 |
-71.72 |
3.77 |
-8.79 |
0.14 |
0 |
|
|
291899 |
113635237 |
1 |
ClON4C12H17 |
ABC4D12E17 |
-16.97 |
2.6 |
-9.14 |
-0.63 |
0 |
|
|
291900 |
113635238 |
1 |
O2N3C12H23 |
A2B3C12D23 |
-98.03 |
3.22 |
-8.96 |
1.19 |
0 |
|
|
291901 |
113635242 |
2 |
ON2C6H12 |
AB2C6D12 |
-107.86 |
3.91 |
-8.79 |
0.29 |
0 |
|
|
291902 |
113635243 |
1 |
N2O3C13H20 |
A2B3C13D20 |
-107.29 |
1.86 |
-8.88 |
-0.12 |
0 |
|
|
291903 |
113635244 |
1 |
OSN4C12H16 |
ABC4D12E16 |
58.99 |
2.49 |
-8.88 |
-1.21 |
0 |
|
|
291904 |
113635291 |
1 |
FON3C13H18 |
ABC3D13E18 |
-67.12 |
3.17 |
-8.92 |
-0.62 |
0 |
|
|
291905 |
113667135 |
1 |
NC16H33 |
AB16C33 |
-63.12 |
1.46 |
-8.53 |
3.16 |
0 |
|
|
291906 |
113690385 |
1 |
NOC16H27 |
ABC16D27 |
-53.4 |
1.22 |
-8.86 |
0.48 |
0 |
|
|
291907 |
113711237 |
1 |
BrFON2H12C13 |
ABCD2E12F13 |
-14.51 |
4.85 |
-9.29 |
-0.6 |
0 |
|
|
291908 |
113735865 |
1 |
BrNO2C13H18 |
ABC2D13E18 |
-79.3 |
4.36 |
-9.01 |
-0.34 |
0 |
|
|
291909 |
113739208 |
1 |
N3O3C13H21 |
A3B3C13D21 |
-121.51 |
1.49 |
-9.64 |
0.03 |
0 |
|
|
291910 |
113751988 |
1 |
OSN2H14C15 |
ABC2D14E15 |
37.18 |
3.41 |
-8.71 |
-0.7 |
0 |
|
|
291911 |
113769568 |
1 |
ClN4C12H19 |
AB4C12D19 |
21.15 |
3.59 |
-9.1 |
-0.88 |
0 |
|
|
291912 |
113771437 |
1 |
N2C15H30 |
A2B15C30 |
-30.84 |
2.09 |
-8.33 |
1.33 |
0 |
|
|
291913 |
113771443 |
1 |
ON2C14H28 |
AB2C14D28 |
-63.47 |
2.89 |
-8.63 |
1.12 |
0 |
|
|
291914 |
113771555 |
1 |
N2F3C12H23 |
A2B3C12D23 |
-178.43 |
4.95 |
-8.98 |
0.72 |
0 |
|
|
291915 |
113771577 |
1 |
FN2C15H23 |
AB2C15D23 |
-31.04 |
4.92 |
-8.14 |
0.21 |
0 |
|
|
291916 |
113771588 |
2 |
NC8H13 |
AB8C13 |
13.29 |
2.32 |
-7.93 |
0.61 |
0 |
|
|
291917 |
113775684 |
1 |
SN2O2C12H20 |
AB2C2D12E20 |
-65.49 |
5.98 |
-9.08 |
-0.42 |
0 |
|
|
291918 |
113787783 |
1 |
N5C12H17 |
A5B12C17 |
73.19 |
2.46 |
-8.88 |
-1.05 |
0 |
|
|
291919 |
113790399 |
1 |
ON2C14H30 |
AB2C14D30 |
-61.57 |
3.06 |
-8.46 |
1.39 |
0 |
|
|
291920 |
113796942 |
1 |
NOC15H29 |
ABC15D29 |
-79.49 |
1.13 |
-8.79 |
2.32 |
0 |
|
|
291921 |
113797392 |
1 |
NC17H33 |
AB17C33 |
-56.59 |
2.07 |
-8.78 |
1.66 |
0 |
|
|
291922 |
113803087 |
1 |
OSN4C12H18 |
ABC4D12E18 |
-8.8 |
5.39 |
-8.28 |
-0.25 |
0 |
|
|
291923 |
113807800 |
1 |
OSN2F3C10H17 |
ABC2D3E10F17 |
-200.95 |
1.62 |
-9.09 |
-0.89 |
0 |
|
|
291924 |
113810343 |
1 |
ON2C14H24 |
AB2C14D24 |
-36.72 |
2.4 |
-8.98 |
0.43 |
0 |