List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
282050 |
103914801 |
1 |
NO3C17H33 |
AB3C17D33 |
-176.35 |
2.2 |
-9.26 |
1.88 |
0 |
|
|
282051 |
103914802 |
1 |
ClNO3C16H24 |
ABC3D16E24 |
-133.73 |
6.2 |
-8.86 |
-0.1 |
0 |
|
|
282052 |
103914805 |
1 |
NCl2O2C15H21 |
AB2C2D15E21 |
-104.72 |
4.49 |
-9.24 |
-0.74 |
0 |
|
|
282053 |
103914903 |
1 |
SO3N4C13H22 |
AB3C4D13E22 |
-123.65 |
2.9 |
-9.36 |
0.06 |
0 |
|
|
282054 |
103914905 |
1 |
SO3N5C10H15 |
AB3C5D10E15 |
-46.32 |
4.22 |
-10.07 |
-0.37 |
0 |
|
|
282055 |
103914911 |
1 |
S2N4O4C9H18 |
A2B4C4D9E18 |
-151.61 |
6.79 |
-9.71 |
0.36 |
0 |
|
|
282056 |
103914912 |
1 |
O2S2N4C11H20 |
A2B2C4D11E20 |
-58.78 |
4.74 |
-8.6 |
-0.04 |
0 |
|
|
282057 |
103914916 |
1 |
SO2N5C11H17 |
AB2C5D11E17 |
-23.61 |
3.8 |
-9.31 |
0.02 |
0 |
|
|
282058 |
103914964 |
1 |
SN3O3C12H21 |
AB3C3D12E21 |
-121.64 |
5.58 |
-9.55 |
0.03 |
0 |
|
|
282059 |
103914989 |
1 |
ON5C12H17 |
AB5C12D17 |
7.48 |
3.7 |
-8.86 |
-0.85 |
0 |
|
|
282060 |
103915031 |
1 |
BrON4C9H13 |
ABC4D9E13 |
-19.27 |
7.2 |
-9.15 |
-0.48 |
0 |
|
|
282061 |
103915039 |
1 |
BrN3C17H20 |
AB3C17D20 |
52.86 |
1.9 |
-8.54 |
-0.08 |
0 |
|
|
282062 |
103915040 |
1 |
BrON2C11H15 |
ABC2D11E15 |
-29.83 |
3.84 |
-8.58 |
0.03 |
0 |
|
|
282063 |
103915041 |
1 |
BrN3C16H18 |
AB3C16D18 |
57.84 |
1.47 |
-8.37 |
-0.09 |
0 |
|
|
282064 |
103915055 |
1 |
BrSO2N3C14H16 |
ABC2D3E14F16 |
-33.91 |
5.84 |
-8.81 |
-0.7 |
0 |
|
|
282065 |
103915088 |
1 |
BrON3C11H16 |
ABC3D11E16 |
-36.86 |
4.37 |
-8.65 |
-0.03 |
0 |
|
|
282066 |
103915089 |
1 |
BrON3C12H18 |
ABC3D12E18 |
-44.79 |
4.43 |
-8.63 |
-0.02 |
0 |
|
|
282067 |
103915106 |
1 |
BrON2C12H17 |
ABC2D12E17 |
-35.77 |
1.47 |
-8.68 |
-0.06 |
0 |
|
|
282068 |
103915108 |
1 |
BrN3C13H20 |
AB3C13D20 |
16.0 |
2.57 |
-8.46 |
-0.03 |
0 |
|
|
282069 |
103915210 |
1 |
NBr2O2C13H15 |
AB2C2D13E15 |
-66.2 |
3.3 |
-9.79 |
-0.9 |
0 |
|
|
282070 |
103915211 |
1 |
BrClNO2C13H15 |
ABCD2E13F15 |
-77.46 |
5.74 |
-9.78 |
-0.88 |
0 |
|
|
282071 |
103915235 |
1 |
FNSO2C14H22 |
ABCD2E14F22 |
-136.98 |
5.49 |
-9.44 |
-0.07 |
0 |
|
|
282072 |
103915238 |
1 |
NO2C17H29 |
AB2C17D29 |
-105.16 |
3.13 |
-8.69 |
0.2 |
0 |
|
|
282073 |
103915241 |
1 |
N2O2C17H28 |
A2B2C17D28 |
-93.23 |
4.7 |
-8.51 |
0.47 |
0 |
|
|
282074 |
103915258 |
1 |
BrN4C15H19 |
AB4C15D19 |
58.08 |
7.19 |
-9.5 |
-0.31 |
0 |
|
|
282075 |
103915271 |
1 |
BrClN3C14H17 |
ABC3D14E17 |
48.27 |
1.71 |
-9.03 |
-0.12 |
0 |
|
|
282076 |
103915273 |
1 |
BrNO3C16H18 |
ABC3D16E18 |
-72.34 |
1.77 |
-9.46 |
-0.65 |
0 |
|
|
282077 |
103915310 |
1 |
ClN3O5C10H12 |
AB3C5D10E12 |
-107.23 |
4.51 |
-9.9 |
-2.14 |
0 |
|
|
282078 |
103915321 |
1 |
BrFNO3C11H13 |
ABCD3E11F13 |
-154.09 |
5.24 |
-9.69 |
-0.66 |
0 |
|
|
282079 |
103915329 |
1 |
BrNO3C12H16 |
ABC3D12E16 |
-120.93 |
3.57 |
-9.4 |
-0.7 |
0 |
|
|
282080 |
103915330 |
1 |
NO3F4C7H11 |
AB3C4D7E11 |
-332.03 |
1.75 |
-10.28 |
-0.28 |
0 |
|
|
282081 |
103915390 |
1 |
NF3O3C14H18 |
AB3C3D14E18 |
-285.55 |
3.1 |
-9.06 |
0.2 |
0 |
|
|
282082 |
103915458 |
1 |
N2F3O5C9H9 |
A2B3C5D9E9 |
-249.34 |
4.25 |
-10.41 |
-1.9 |
0 |
|
|
282083 |
103915532 |
1 |
ClINO2F3H10C11 |
ABCD2E3F10G11 |
-215.69 |
2.87 |
-9.86 |
-1.61 |
0 |
|
|
282084 |
103915533 |
1 |
F3N3O3C10H12 |
A3B3C3D10E12 |
-260.7 |
1.44 |
-9.9 |
-1.01 |
0 |
|
|
282085 |
103915555 |
1 |
O2F3N4C9H13 |
A2B3C4D9E13 |
-202.01 |
1.24 |
-10.42 |
-0.41 |
0 |
|
|
282086 |
103915556 |
1 |
NSO3F5C11H12 |
ABC3D5E11F12 |
-359.48 |
5.14 |
-9.78 |
-1.13 |
0 |
|
|
282087 |
103915561 |
1 |
N2F3O4C10H13 |
A2B3C4D10E13 |
-272.15 |
2.27 |
-9.98 |
-0.12 |
0 |
|
|
282088 |
103915564 |
1 |
ClNO2F3C12H13 |
ABC2D3E12F13 |
-247.48 |
1.7 |
-9.86 |
-0.69 |
0 |
|
|
282089 |
103915595 |
1 |
SO2F3N4C11H17 |
AB2C3D4E11F17 |
-216.7 |
4.77 |
-9.21 |
-0.66 |
0 |
|
|
282090 |
103915673 |
1 |
N2O2F3C11H13 |
A2B2C3D11E13 |
-222.05 |
5.79 |
-10.12 |
-0.83 |
0 |
|
|
282091 |
103915731 |
1 |
SN2O3C9H12 |
AB2C3D9E12 |
-104.88 |
1.92 |
-9.77 |
-1.15 |
0 |
|
|
282092 |
103915735 |
1 |
N2O5C12H14 |
A2B5C12D14 |
-120.9 |
3.88 |
-10.04 |
-1.45 |
0 |
|
|
282093 |
103915750 |
1 |
NF2O3C12H13 |
AB2C3D12E13 |
-209.65 |
4.31 |
-9.9 |
-0.85 |
0 |
|
|
282094 |
103915774 |
1 |
ClON2C14H17 |
ABC2D14E17 |
21.9 |
2.4 |
-9.43 |
-0.24 |
0 |
|
|
282095 |
103915915 |
1 |
N3O3C17H29 |
A3B3C17D29 |
-140.11 |
3.55 |
-9.2 |
0.85 |
0 |
|
|
282096 |
103915929 |
1 |
N3O4C15H25 |
A3B4C15D25 |
-151.45 |
2.73 |
-9.6 |
-0.29 |
0 |
|
|
282097 |
103915930 |
1 |
N2O3C18H34 |
A2B3C18D34 |
-189.89 |
1.17 |
-8.69 |
0.99 |
0 |
|
|
282098 |
103915933 |
1 |
NSO5C15H29 |
ABC5D15E29 |
-268.72 |
1.68 |
-9.5 |
0.71 |
0 |
|
|
282099 |
103915958 |
1 |
BrNO4C16H24 |
ABC4D16E24 |
-173.77 |
2.53 |
-9.24 |
-0.48 |
0 |