List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
368992 |
127331096 |
2 |
ON2C10H15 |
AB2C10D15 |
-81.98 |
2.81 |
-8.94 |
-0.16 |
0 |
|
|
368993 |
127331097 |
1 |
O2N5C15H25 |
A2B5C15D25 |
-78.53 |
4.4 |
-9.09 |
0.7 |
0 |
|
|
368994 |
127331098 |
1 |
SO2N3C20H33 |
AB2C3D20E33 |
-103.78 |
1.66 |
-8.9 |
-0.02 |
0 |
|
|
368995 |
127331099 |
1 |
SO2N3C20H33 |
AB2C3D20E33 |
-100.1 |
2.28 |
-8.92 |
0.04 |
0 |
|
|
368996 |
127331100 |
1 |
O3N5C19H35 |
A3B5C19D35 |
-155.74 |
4.73 |
-8.55 |
0.74 |
0 |
|
|
368997 |
127331101 |
1 |
SN2O2C15H20 |
AB2C2D15E20 |
-76.54 |
2.35 |
-8.61 |
-0.22 |
0 |
|
|
368998 |
127331102 |
1 |
ON5C16H27 |
AB5C16D27 |
-22.04 |
3.55 |
-8.64 |
-0.68 |
0 |
|
|
368999 |
127331103 |
2 |
ON3C9H15 |
AB3C9D15 |
-62.96 |
1.83 |
-8.64 |
0.2 |
0 |
|
|
369000 |
127331104 |
1 |
OSN4C12H18 |
ABC4D12E18 |
-9.51 |
3.12 |
-8.6 |
-0.94 |
0 |
|
|
369001 |
127331105 |
1 |
SO2N3C14H17 |
AB2C3D14E17 |
-69.83 |
4.35 |
-8.54 |
-0.16 |
0 |
|
|
369002 |
127331106 |
1 |
O3N6C14H20 |
A3B6C14D20 |
-87.96 |
2.76 |
-8.62 |
0.18 |
0 |
|
|
369003 |
127331107 |
1 |
SN3O3C20H35 |
AB3C3D20E35 |
-183.42 |
5.98 |
-8.83 |
0.44 |
0 |
|
|
369004 |
127331108 |
1 |
SO2N5C18H27 |
AB2C5D18E27 |
-52.12 |
5.09 |
-8.73 |
-1.02 |
0 |
|
|
369005 |
127331109 |
1 |
O2N5C13H23 |
A2B5C13D23 |
-66.02 |
8.34 |
-9.93 |
0.24 |
0 |
|
|
369006 |
127331110 |
1 |
OSN5C16H19 |
ABC5D16E19 |
14.0 |
1.23 |
-8.71 |
-0.34 |
0 |
|
|
369007 |
127331111 |
1 |
ON6C20H28 |
AB6C20D28 |
9.1 |
2.98 |
-8.15 |
0.45 |
0 |
|
|
369008 |
127331112 |
2 |
ON4C8H11 |
AB4C8D11 |
-5.49 |
2.47 |
-8.7 |
0.09 |
0 |
|
|
369009 |
127331113 |
2 |
N2O2C7H13 |
A2B2C7D13 |
-181.09 |
8.38 |
-9.09 |
0.76 |
0 |
|
|
369010 |
127331114 |
1 |
O2N5C13H21 |
A2B5C13D21 |
-44.69 |
3.68 |
-8.83 |
-0.64 |
0 |
|
|
369011 |
127331115 |
1 |
O2N3C17H33 |
A2B3C17D33 |
-132.32 |
2.52 |
-8.55 |
1.24 |
0 |
|
|
369012 |
127331116 |
2 |
N2O2C9H16 |
A2B2C9D16 |
-198.08 |
8.39 |
-9.18 |
0.8 |
0 |
|
|
369013 |
127331117 |
1 |
O2N5C15H25 |
A2B5C15D25 |
-51.66 |
2.84 |
-9.01 |
-0.57 |
0 |
|
|
369014 |
127331118 |
1 |
SN2O2C14H18 |
AB2C2D14E18 |
-73.5 |
4.07 |
-8.6 |
-0.15 |
0 |
|
|
369015 |
127331119 |
2 |
ON2C6H9 |
AB2C6D9 |
-50.86 |
3.42 |
-9.44 |
-0.74 |
0 |
|
|
369016 |
127331120 |
1 |
ON5C15H23 |
AB5C15D23 |
7.24 |
2.39 |
-8.85 |
-0.9 |
0 |
|
|
369017 |
127331121 |
1 |
O2N7C17H29 |
A2B7C17D29 |
-47.37 |
2.94 |
-8.36 |
0.27 |
0 |
|
|
369018 |
127331122 |
1 |
S2N4O5C14H26 |
A2B4C5D14E26 |
-226.72 |
5.83 |
-8.59 |
0.18 |
0 |
|
|
369019 |
127331123 |
1 |
O2N5C22H29 |
A2B5C22D29 |
-36.43 |
2.48 |
-8.61 |
0.25 |
0 |
|
|
369020 |
127331124 |
1 |
N2O3C19H28 |
A2B3C19D28 |
-143.62 |
2.49 |
-8.75 |
0.28 |
0 |
|
|
369021 |
127331127 |
1 |
O3N7C18H29 |
A3B7C18D29 |
-93.34 |
5.01 |
-8.65 |
0.22 |
0 |
|
|
369022 |
127331128 |
1 |
O2N5C19H23 |
A2B5C19D23 |
-26.21 |
2.63 |
-8.65 |
0.21 |
0 |
|
|
369023 |
127331129 |
1 |
O2N3C23H35 |
A2B3C23D35 |
-99.93 |
4.53 |
-8.93 |
0.52 |
0 |
|
|
369024 |
127331130 |
1 |
O2N3C17H33 |
A2B3C17D33 |
-136.22 |
4.5 |
-8.89 |
1.24 |
0 |
|
|
369025 |
127331131 |
1 |
O3N4C16H30 |
A3B4C16D30 |
-155.83 |
2.62 |
-8.6 |
0.88 |
0 |
|
|
369026 |
127331132 |
2 |
ON2C8H16 |
AB2C8D16 |
-117.77 |
2.45 |
-8.44 |
1.36 |
0 |
|
|
369027 |
127331133 |
1 |
O2F3N5C13H16 |
A2B3C5D13E16 |
-201.17 |
1.8 |
-9.65 |
-1.06 |
0 |
|
|
369028 |
127331134 |
1 |
F3O3N6C15H19 |
A3B3C6D15E19 |
-242.73 |
2.01 |
-8.68 |
-0.08 |
0 |
|
|
369029 |
127331135 |
1 |
SO2N3C15H29 |
AB2C3D15E29 |
-123.48 |
3.2 |
-8.67 |
0.59 |
0 |
|
|
369030 |
127331136 |
1 |
SO3N4C14H26 |
AB3C4D14E26 |
-143.51 |
6.19 |
-8.78 |
0.5 |
0 |
|
|
369031 |
127331137 |
1 |
O2N5C20H33 |
A2B5C20D33 |
-98.08 |
3.03 |
-8.96 |
-0.14 |
0 |
|
|
369032 |
127331138 |
1 |
O2N3C16H29 |
A2B3C16D29 |
-103.82 |
2.58 |
-8.92 |
1.17 |
0 |
|
|
369033 |
127331139 |
1 |
ON5C14H21 |
AB5C14D21 |
17.16 |
3.4 |
-8.9 |
-1.01 |
0 |
|
|
369034 |
127331140 |
2 |
ON3C8H12 |
AB3C8D12 |
-24.66 |
1.67 |
-8.64 |
0.2 |
0 |
|
|
369035 |
127331141 |
1 |
ON7C15H21 |
AB7C15D21 |
32.1 |
3.26 |
-9.57 |
-0.78 |
0 |
|
|
369036 |
127331155 |
1 |
ON6C19H34 |
AB6C19D34 |
-26.05 |
2.65 |
-8.68 |
0.66 |
0 |
|
|
369037 |
127331156 |
1 |
O3N6C14H20 |
A3B6C14D20 |
-86.4 |
4.91 |
-8.77 |
0.06 |
0 |
|
|
369038 |
127331157 |
2 |
ON3C10H16 |
AB3C10D16 |
-61.34 |
2.92 |
-8.62 |
0.25 |
0 |
|
|
369039 |
127331161 |
1 |
O3N6C18H26 |
A3B6C18D26 |
-92.35 |
6.04 |
-8.66 |
0.18 |
0 |
|
|
369040 |
127331162 |
1 |
O3N5C16H23 |
A3B5C16D23 |
-97.63 |
3.09 |
-8.56 |
0.33 |
0 |
|
|
369041 |
127331163 |
1 |
O2N8C15H20 |
A2B8C15D20 |
4.83 |
6.02 |
-8.82 |
-0.08 |
0 |
|
|
369042 |
127331164 |
1 |
O3N6C16H24 |
A3B6C16D24 |
-92.64 |
1.81 |
-8.63 |
0.19 |
0 |
|
|
369043 |
127331165 |
1 |
O2N5C19H23 |
A2B5C19D23 |
-24.23 |
2.83 |
-8.58 |
0.09 |
0 |
|
|
369044 |
127331166 |
1 |
O3N6C19H28 |
A3B6C19D28 |
-94.63 |
6.92 |
-8.54 |
0.34 |
0 |
|
|
369045 |
127331167 |
1 |
O2N7C16H19 |
A2B7C16D19 |
2.22 |
3.27 |
-8.67 |
-0.56 |
0 |
|
|
369046 |
127331168 |
1 |
SO2N6C17H22 |
AB2C6D17E22 |
-10.47 |
4.0 |
-8.55 |
-0.63 |
0 |
|
|
369047 |
127331169 |
1 |
O2N6C15H24 |
A2B6C15D24 |
-40.58 |
2.89 |
-8.62 |
0.27 |
0 |
|
|
369048 |
127331170 |
1 |
SN3O3C20H31 |
AB3C3D20E31 |
-134.22 |
7.36 |
-9.28 |
0.04 |
0 |
|
|
369049 |
127331171 |
1 |
SN3O4C19H29 |
AB3C4D19E29 |
-165.22 |
6.55 |
-9.46 |
-0.01 |
0 |
|
|
369050 |
127331172 |
1 |
SN3O4C18H27 |
AB3C4D18E27 |
-159.01 |
5.31 |
-9.56 |
0.0 |
0 |
|
|
369051 |
127331173 |
1 |
SO3N4C19H30 |
AB3C4D19E30 |
-113.97 |
6.18 |
-8.93 |
0.0 |
0 |
|
|
369052 |
127331178 |
1 |
ON5C19H31 |
AB5C19D31 |
-35.88 |
3.1 |
-8.52 |
-0.01 |
0 |
|
|
369053 |
127331179 |
1 |
ON5C20H33 |
AB5C20D33 |
-41.89 |
4.75 |
-8.44 |
0.08 |
0 |
|
|
369054 |
127331180 |
1 |
SN2O2C17H24 |
AB2C2D17E24 |
-95.43 |
3.14 |
-8.54 |
-0.17 |
0 |
|
|
369055 |
127331187 |
1 |
SO2N4C17H20 |
AB2C4D17E20 |
-11.99 |
2.89 |
-8.62 |
-0.39 |
0 |
|
|
369056 |
127331188 |
1 |
S2N3O3C14H19 |
A2B3C3D14E19 |
-104.4 |
4.9 |
-8.59 |
-0.23 |
0 |
|
|
369057 |
127331189 |
1 |
S2N3O3C16H23 |
A2B3C3D16E23 |
-118.32 |
8.2 |
-8.13 |
0.09 |
0 |
|
|
369058 |
127331190 |
1 |
S2N3O3C16H23 |
A2B3C3D16E23 |
-114.33 |
3.6 |
-8.63 |
-0.28 |
0 |
|
|
369059 |
127331191 |
1 |
OSN5C17H21 |
ABC5D17E21 |
18.54 |
4.94 |
-8.76 |
-0.4 |
0 |
|
|
369060 |
127331192 |
1 |
SN2O2C20H22 |
AB2C2D20E22 |
-45.94 |
4.55 |
-8.54 |
-0.18 |
0 |
|
|
369061 |
127331193 |
1 |
SO2N3C20H27 |
AB2C3D20E27 |
-84.1 |
5.41 |
-8.54 |
-0.15 |
0 |
|
|
369062 |
127331197 |
1 |
SN2O2C15H20 |
AB2C2D15E20 |
-73.78 |
3.41 |
-8.58 |
-0.23 |
0 |
|
|
369063 |
127331198 |
1 |
OSN4C17H20 |
ABC4D17E20 |
12.5 |
3.8 |
-8.64 |
-0.28 |
0 |
|
|
369064 |
127331199 |
1 |
SO2N3C19H27 |
AB2C3D19E27 |
-96.89 |
1.5 |
-8.63 |
-0.16 |
0 |
|
|
369065 |
127331206 |
1 |
SO2N3C18H25 |
AB2C3D18E25 |
-90.39 |
3.87 |
-8.6 |
-0.23 |
0 |
|
|
369066 |
127331207 |
1 |
SO2N3C18H25 |
AB2C3D18E25 |
-78.73 |
3.82 |
-8.65 |
-0.27 |
0 |