List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
208045 |
80485247 |
1 |
ClSO2N3C14H16 |
ABC2D3E14F16 |
-43.62 |
7.65 |
-9.02 |
-0.81 |
0 |
|
|
208046 |
80485575 |
1 |
NOC13H17 |
ABC13D17 |
-16.17 |
2.82 |
-7.78 |
0.3 |
0 |
|
|
208047 |
80485681 |
1 |
ON2C15H22 |
AB2C15D22 |
-42.0 |
1.54 |
-7.93 |
0.43 |
0 |
|
|
208048 |
80485682 |
1 |
ClNC14H20 |
ABC14D20 |
-0.53 |
1.73 |
-8.91 |
0.16 |
0 |
|
|
208049 |
80485739 |
1 |
N3C14H17 |
A3B14C17 |
58.72 |
6.46 |
-8.64 |
-0.37 |
0 |
|
|
208050 |
80485796 |
1 |
NSO2C13H19 |
ABC2D13E19 |
-70.45 |
6.61 |
-8.57 |
-0.31 |
0 |
|
|
208051 |
80485847 |
1 |
OF2N2C12H14 |
AB2C2D12E14 |
-111.7 |
2.71 |
-8.81 |
-0.73 |
0 |
|
|
208052 |
80486175 |
1 |
N3C12H19 |
A3B12C19 |
21.6 |
1.59 |
-9.65 |
-0.16 |
0 |
|
|
208053 |
80486639 |
1 |
N2C7H12 |
A2B7C12 |
28.77 |
2.29 |
-9.67 |
1.07 |
0 |
|
|
208054 |
80486856 |
1 |
N4C13H16 |
A4B13C16 |
80.19 |
3.35 |
-8.73 |
-0.04 |
0 |
|
|
208055 |
80486912 |
1 |
N4C11H20 |
A4B11C20 |
32.01 |
3.5 |
-8.1 |
0.75 |
0 |
|
|
208056 |
80486913 |
1 |
N4C13H22 |
A4B13C22 |
32.29 |
4.17 |
-8.25 |
0.64 |
0 |
|
|
208057 |
80487353 |
1 |
N5C6H11 |
A5B6C11 |
75.9 |
2.65 |
-8.49 |
0.44 |
0 |
|
|
208058 |
80487354 |
1 |
C5N5H11 |
A5B5C11 |
48.74 |
2.91 |
-8.42 |
0.53 |
0 |
|
|
208059 |
80487355 |
1 |
N5C13H19 |
A5B13C19 |
63.25 |
1.65 |
-8.35 |
-0.1 |
0 |
|
|
208060 |
80487463 |
1 |
N5C11H15 |
A5B11C15 |
67.03 |
2.84 |
-8.35 |
-0.27 |
0 |
|
|
208061 |
80487464 |
1 |
N5C12H17 |
A5B12C17 |
64.17 |
3.81 |
-8.26 |
-0.23 |
0 |
|
|
208062 |
80487465 |
1 |
O2N6C11H12 |
A2B6C11D12 |
100.03 |
5.48 |
-8.87 |
-1.64 |
0 |
|
|
208063 |
80487466 |
1 |
O2N6C9H10 |
A2B6C9D10 |
86.38 |
5.27 |
-8.72 |
-1.19 |
0 |
|
|
208064 |
80487467 |
1 |
N5C9H17 |
A5B9C17 |
55.55 |
2.57 |
-8.44 |
0.46 |
0 |
|
|
208065 |
80487739 |
1 |
N5C10H13 |
A5B10C13 |
71.98 |
3.38 |
-8.55 |
-0.31 |
0 |
|
|
208066 |
80488293 |
1 |
N5C15H23 |
A5B15C23 |
39.95 |
2.49 |
-8.22 |
0.02 |
0 |
|
|
208067 |
80489471 |
1 |
BrClSN3H7C9 |
ABCD3E7F9 |
81.54 |
5.9 |
-9.33 |
-1.16 |
0 |
|
|
208068 |
80490032 |
1 |
ClFN5H7C8 |
ABC5D7E8 |
46.01 |
6.1 |
-9.16 |
-1.08 |
0 |
|
|
208069 |
80490033 |
1 |
N5C10H13 |
A5B10C13 |
83.13 |
4.99 |
-9.01 |
-0.33 |
0 |
|
|
208070 |
80490034 |
1 |
ON5C8H9 |
AB5C8D9 |
56.63 |
5.23 |
-9.23 |
-0.66 |
0 |
|
|
208071 |
80491880 |
1 |
SN2C13H16 |
AB2C13D16 |
47.66 |
2.31 |
-8.92 |
-0.48 |
0 |
|
|
208072 |
80491881 |
1 |
ClOSN2C12H13 |
ABCD2E12F13 |
15.71 |
3.59 |
-8.85 |
-0.52 |
0 |
|
|
208073 |
80491882 |
1 |
FOSN2C13H15 |
ABCD2E13F15 |
-27.78 |
2.83 |
-8.79 |
-0.58 |
0 |
|
|
208074 |
80491883 |
1 |
SN2C9H14 |
AB2C9D14 |
39.28 |
1.53 |
-9.0 |
-0.41 |
0 |
|
|
208075 |
80491967 |
1 |
S2N3C9H11 |
A2B3C9D11 |
59.1 |
2.99 |
-9.24 |
-0.61 |
0 |
|
|
208076 |
80492172 |
1 |
ClSN4C13H19 |
ABC4D13E19 |
51.47 |
2.1 |
-8.92 |
-0.46 |
0 |
|
|
208077 |
80492398 |
1 |
BrSN4H5C7 |
ABC4D5E7 |
85.86 |
0.95 |
-9.29 |
-1.16 |
0 |
|
|
208078 |
80492404 |
1 |
SN2C17H22 |
AB2C17D22 |
34.5 |
2.5 |
-8.85 |
-0.49 |
0 |
|
|
208079 |
80492405 |
1 |
SN4C14H22 |
AB4C14D22 |
46.13 |
1.69 |
-9.09 |
-0.66 |
0 |
|
|
208080 |
80492689 |
1 |
ISN4C11H13 |
ABC4D11E13 |
84.19 |
3.43 |
-9.0 |
-1.03 |
0 |
|
|
208081 |
80492724 |
1 |
N2O2S2H8C13 |
A2B2C2D8E13 |
19.86 |
6.43 |
-9.08 |
-1.42 |
0 |
|
|
208082 |
80492825 |
2 |
NOC5H9 |
ABC5D9 |
-74.93 |
4.68 |
-9.37 |
1.03 |
0 |
|
|
208083 |
80492826 |
1 |
ON4C10H12 |
AB4C10D12 |
56.93 |
5.18 |
-9.38 |
-1.04 |
0 |
|
|
208084 |
80493044 |
2 |
SN2C4H5 |
AB2C4D5 |
81.87 |
3.47 |
-8.93 |
-0.86 |
0 |
|
|
208085 |
80493575 |
1 |
SN2C14H18 |
AB2C14D18 |
41.73 |
1.0 |
-8.91 |
-0.47 |
0 |
|
|
208086 |
80493663 |
1 |
N2O2C13H18 |
A2B2C13D18 |
-61.33 |
3.84 |
-8.5 |
0.09 |
0 |
|
|
208087 |
80493803 |
1 |
ON5C6H11 |
AB5C6D11 |
51.51 |
4.88 |
-9.67 |
-0.53 |
0 |
|
|
208088 |
80493804 |
1 |
OC5N5H9 |
AB5C5D9 |
57.61 |
2.23 |
-9.7 |
-0.67 |
0 |
|
|
208089 |
80493805 |
1 |
FNOC12H16 |
ABCD12E16 |
-68.01 |
2.38 |
-9.35 |
-0.04 |
0 |
|
|
208090 |
80493806 |
1 |
NO2C8H17 |
AB2C8D17 |
-88.13 |
2.21 |
-9.36 |
1.93 |
0 |
|
|
208091 |
80493853 |
1 |
FNO3C10H10 |
ABC3D10E10 |
-127.13 |
5.42 |
-9.25 |
-1.06 |
0 |
|
|
208092 |
80494859 |
2 |
ON2C6H10 |
AB2C6D10 |
-46.76 |
3.47 |
-9.58 |
-0.17 |
0 |
|
|
208093 |
80495145 |
1 |
ClNO3C11H12 |
ABC3D11E12 |
-87.94 |
3.65 |
-8.75 |
-0.17 |
0 |
|
|
208094 |
80495154 |
1 |
ON6C8H12 |
AB6C8D12 |
86.03 |
2.9 |
-9.66 |
-0.83 |
0 |