List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
71002 |
48414166 |
1 |
O3N5C17H17 |
A3B5C17D17 |
-59.9 |
11.39 |
-9.28 |
-1.18 |
0 |
|
|
71003 |
48414167 |
1 |
ClION3H11C12 |
ABCD3E11F12 |
23.9 |
5.41 |
-9.72 |
-1.39 |
0 |
|
|
71004 |
48414169 |
1 |
ClION3H11C12 |
ABCD3E11F12 |
22.83 |
6.22 |
-9.6 |
-1.29 |
0 |
|
|
71005 |
48414170 |
1 |
FO2N5C17H18 |
AB2C5D17E18 |
-24.49 |
4.12 |
-9.58 |
-1.16 |
0 |
|
|
71006 |
48414171 |
1 |
Cl2O2N3C14H15 |
A2B2C3D14E15 |
-46.52 |
4.24 |
-9.38 |
-0.6 |
0 |
|
|
71007 |
48414172 |
1 |
BrFO2N3C14H15 |
ABC2D3E14F15 |
-73.56 |
3.05 |
-9.55 |
-0.88 |
0 |
|
|
71008 |
48414173 |
1 |
SO2N5C15H17 |
AB2C5D15E17 |
29.01 |
1.22 |
-9.35 |
-1.06 |
0 |
|
|
71009 |
48414174 |
1 |
FION3H11C12 |
ABCD3E11F12 |
-17.57 |
0.55 |
-9.51 |
-1.46 |
0 |
|
|
71010 |
48414175 |
1 |
O2F3N3C10H14 |
A2B3C3D10E14 |
-221.31 |
3.7 |
-9.7 |
0.36 |
0 |
|
|
71011 |
48414176 |
1 |
OCl2N3C14H15 |
AB2C3D14E15 |
-18.15 |
0.96 |
-9.54 |
-0.45 |
0 |
|
|
71012 |
48414177 |
1 |
O2N5C17H19 |
A2B5C17D19 |
10.05 |
4.56 |
-9.62 |
-0.99 |
0 |
|
|
71013 |
48414178 |
2 |
ON2C9H10 |
AB2C9D10 |
-10.35 |
7.44 |
-9.3 |
-0.88 |
0 |
|
|
71014 |
48414180 |
1 |
BrO3N4C15H15 |
AB3C4D15E15 |
-57.08 |
5.04 |
-8.98 |
-0.78 |
0 |
|
|
71015 |
48414181 |
1 |
OCl2N5C18H19 |
AB2C5D18E19 |
20.76 |
2.71 |
-9.08 |
-0.95 |
0 |
|
|
71016 |
48414182 |
1 |
N3O3C15H19 |
A3B3C15D19 |
-68.89 |
1.75 |
-9.09 |
0.09 |
0 |
|
|
71017 |
48414184 |
1 |
N3O3C17H21 |
A3B3C17D21 |
-88.3 |
7.55 |
-9.44 |
-0.42 |
0 |
|
|
71018 |
48414185 |
1 |
N3O3C15H19 |
A3B3C15D19 |
-70.57 |
4.88 |
-9.01 |
0.06 |
0 |
|
|
71019 |
48414186 |
1 |
O2N3C19H21 |
A2B3C19D21 |
-21.89 |
5.54 |
-8.47 |
-0.28 |
0 |
|
|
71020 |
48414187 |
1 |
ClON5H12C13 |
ABC5D12E13 |
40.92 |
2.5 |
-9.36 |
-0.94 |
0 |
|
|
71021 |
48414188 |
1 |
O2N6C15H16 |
A2B6C15D16 |
41.72 |
5.59 |
-9.82 |
-1.03 |
0 |
|
|
71022 |
48414189 |
1 |
O3N4C17H20 |
A3B4C17D20 |
-41.42 |
10.86 |
-8.72 |
-0.46 |
0 |
|
|
71023 |
48414192 |
2 |
N2O2H8C9 |
A2B2C8D9 |
1.7 |
12.66 |
-9.64 |
-1.42 |
0 |
|
|
71024 |
48414193 |
1 |
ON6C20H26 |
AB6C20D26 |
42.68 |
5.99 |
-8.83 |
-0.57 |
0 |
|
|
71025 |
48414194 |
1 |
O2N4C17H26 |
A2B4C17D26 |
-85.87 |
4.21 |
-9.26 |
0.76 |
0 |
|
|
71026 |
48414195 |
1 |
N3O4C18H23 |
A3B4C18D23 |
-114.14 |
9.16 |
-8.67 |
-0.4 |
0 |
|
|
71027 |
48414196 |
1 |
ON6C20H28 |
AB6C20D28 |
10.62 |
6.41 |
-8.87 |
-0.53 |
0 |
|
|
71028 |
48414197 |
1 |
F2N3O3C14H15 |
A2B3C3D14E15 |
-171.71 |
4.95 |
-9.38 |
-0.62 |
0 |
|
|
71029 |
48414198 |
1 |
ON5C12H17 |
AB5C12D17 |
14.04 |
5.73 |
-9.51 |
0.15 |
0 |
|
|
71030 |
48414199 |
1 |
SO2N5C11H15 |
AB2C5D11E15 |
2.37 |
3.95 |
-9.27 |
-0.65 |
0 |
|
|
71031 |
48414200 |
1 |
SO2N4C18H18 |
AB2C4D18E18 |
-0.33 |
3.7 |
-9.44 |
-0.93 |
0 |
|
|
71032 |
48414201 |
1 |
O2F3N4C18H19 |
A2B3C4D18E19 |
-197.73 |
8.32 |
-9.74 |
-0.47 |
0 |
|
|
71033 |
48414202 |
1 |
O3N5C21H25 |
A3B5C21D25 |
-91.67 |
8.04 |
-8.92 |
-0.33 |
0 |
|
|
71034 |
48414203 |
1 |
BrO2N3C15H18 |
AB2C3D15E18 |
-36.46 |
2.1 |
-9.04 |
-0.17 |
0 |
|
|
71035 |
48414204 |
1 |
O2N5C17H19 |
A2B5C17D19 |
7.28 |
4.54 |
-9.4 |
-0.53 |
0 |
|
|
71036 |
48414205 |
1 |
SN3O3C15H19 |
AB3C3D15E19 |
-75.4 |
4.51 |
-9.89 |
-1.06 |
0 |
|
|
71037 |
48414206 |
1 |
N3O4C18H19 |
A3B4C18D19 |
-61.64 |
2.99 |
-8.6 |
-0.46 |
0 |
|
|
71038 |
48414207 |
1 |
ClO2F3N4H12C13 |
AB2C3D4E12F13 |
-185.54 |
2.07 |
-9.68 |
-1.04 |
0 |
|
|
71039 |
48414209 |
1 |
FON5C18H20 |
ABC5D18E20 |
-13.32 |
4.41 |
-9.05 |
-0.52 |
0 |
|
|
71040 |
48414210 |
1 |
S2O3N4C16H16 |
A2B3C4D16E16 |
-27.5 |
4.05 |
-9.24 |
-1.2 |
0 |
|
|
71041 |
48414211 |
1 |
OF3N6C18H19 |
AB3C6D18E19 |
-107.5 |
6.19 |
-9.6 |
-1.51 |
0 |
|
|
71042 |
48414212 |
1 |
ON6C16H18 |
AB6C16D18 |
56.23 |
4.21 |
-9.37 |
-0.91 |
0 |
|
|
71043 |
48414214 |
1 |
Cl2O2N4C17H18 |
A2B2C4D17E18 |
-51.45 |
4.62 |
-9.47 |
-1.07 |
0 |
|
|
71044 |
48414215 |
1 |
SO2N4C15H16 |
AB2C4D15E16 |
-1.49 |
4.43 |
-8.99 |
-1.09 |
0 |
|
|
71045 |
48414216 |
1 |
FO2N4C17H19 |
AB2C4D17E19 |
-84.4 |
6.48 |
-8.96 |
-0.37 |
0 |
|
|
71046 |
48414217 |
1 |
O2F3N3C14H14 |
A2B3C3D14E14 |
-187.18 |
3.8 |
-9.63 |
-0.79 |
0 |
|
|
71047 |
48414218 |
1 |
O3N5C19H21 |
A3B5C19D21 |
-43.95 |
0.68 |
-9.6 |
-0.99 |
0 |
|
|
71048 |
48414219 |
2 |
FON2C8H8 |
ABC2D8E8 |
-122.03 |
6.66 |
-8.97 |
-0.44 |
0 |
|
|
71049 |
48414220 |
1 |
SO2N4C17H18 |
AB2C4D17E18 |
1.72 |
4.71 |
-8.98 |
-0.99 |
0 |
|
|
71050 |
48414222 |
1 |
SO3N4C14H18 |
AB3C4D14E18 |
-60.54 |
6.89 |
-9.27 |
-0.96 |
0 |
|
|
71051 |
48414223 |
1 |
O2N4C11H16 |
A2B4C11D16 |
-42.8 |
2.41 |
-9.54 |
0.49 |
0 |
|
|
71052 |
48414224 |
2 |
ON2C10H10 |
AB2C10D10 |
-8.55 |
6.86 |
-8.98 |
-0.49 |
0 |
|
|
71053 |
48414225 |
2 |
ON2C10H13 |
AB2C10D13 |
-53.6 |
2.86 |
-9.35 |
0.27 |
0 |
|
|
71054 |
48414227 |
1 |
O3N4C11H18 |
A3B4C11D18 |
-117.3 |
5.21 |
-9.62 |
0.42 |
0 |
|
|
71055 |
48414228 |
1 |
O3N4C13H22 |
A3B4C13D22 |
-128.29 |
5.31 |
-9.45 |
0.29 |
0 |
|
|
71056 |
48414229 |
1 |
O3N4C19H24 |
A3B4C19D24 |
-76.33 |
3.21 |
-9.07 |
0.1 |
0 |
|
|
71057 |
48414230 |
1 |
ON5C16H19 |
AB5C16D19 |
15.94 |
4.47 |
-9.16 |
-0.33 |
0 |
|
|
71058 |
48414232 |
1 |
SO3N4C17H22 |
AB3C4D17E22 |
-74.49 |
4.92 |
-9.5 |
-0.75 |
0 |
|
|
71059 |
48414233 |
1 |
FOSN4C17H17 |
ABCD4E17F17 |
-17.28 |
1.63 |
-9.47 |
-1.05 |
0 |
|
|
71060 |
48414234 |
1 |
O2N4C13H20 |
A2B4C13D20 |
-71.87 |
4.05 |
-9.79 |
0.25 |
0 |
|
|
71061 |
48414235 |
1 |
O2N4C17H20 |
A2B4C17D20 |
-21.25 |
7.5 |
-9.03 |
-0.19 |
0 |
|
|
71062 |
48414238 |
1 |
O3N4C12H14 |
A3B4C12D14 |
-60.49 |
4.66 |
-9.74 |
-0.11 |
0 |
|
|
71063 |
48414239 |
1 |
FO2N4H17C19 |
AB2C4D17E19 |
-48.1 |
6.38 |
-9.22 |
-0.87 |
0 |
|
|
71064 |
48414240 |
1 |
O2N4C19H24 |
A2B4C19D24 |
-51.43 |
8.28 |
-9.02 |
-0.3 |
0 |
|
|
71065 |
48414241 |
1 |
OSN4C17H18 |
ABC4D17E18 |
30.7 |
2.71 |
-9.42 |
-0.93 |
0 |
|
|
71066 |
48414242 |
1 |
N3O3C15H17 |
A3B3C15D17 |
-74.22 |
6.83 |
-9.48 |
-0.48 |
0 |
|
|
71067 |
48414244 |
1 |
ON6C15H20 |
AB6C15D20 |
21.22 |
1.95 |
-9.0 |
-0.25 |
0 |
|
|
71068 |
48414245 |
1 |
ON4C18H20 |
AB4C18D20 |
7.12 |
2.83 |
-8.3 |
-0.47 |
0 |
|
|
71069 |
48414246 |
1 |
ON6C15H20 |
AB6C15D20 |
27.19 |
6.24 |
-9.12 |
-0.65 |
0 |
|
|
71070 |
48414248 |
1 |
O2N4C19H20 |
A2B4C19D20 |
-18.41 |
4.59 |
-9.3 |
-1.01 |
0 |
|
|
71071 |
48414249 |
1 |
N4O5C19H24 |
A4B5C19D24 |
-144.28 |
9.65 |
-8.28 |
0.08 |
0 |
|
|
71072 |
48414250 |
1 |
SO3N4C17H22 |
AB3C4D17E22 |
-76.99 |
3.33 |
-9.64 |
-0.89 |
0 |
|
|
71073 |
48414251 |
1 |
S2O3N4C19H20 |
A2B3C4D19E20 |
-33.86 |
3.45 |
-9.04 |
-0.92 |
0 |
|
|
71074 |
48414253 |
1 |
BrO2N4C16H17 |
AB2C4D16E17 |
-29.44 |
8.99 |
-8.96 |
-0.22 |
0 |
|
|
71075 |
48414254 |
1 |
SN4O4C18H24 |
AB4C4D18E24 |
-120.52 |
2.87 |
-9.41 |
-0.82 |
0 |
|
|
71076 |
48414255 |
1 |
BrO2N4C17H19 |
AB2C4D17E19 |
-34.71 |
5.18 |
-8.74 |
-0.18 |
0 |