List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
420183 |
135111709 |
1 |
S2F3N3O3C18H22 |
A2B3C3D3E18F22 |
-248.78 |
2.82 |
-9.43 |
-1.0 |
0 |
|
|
420184 |
135111712 |
1 |
O3N8C17H20 |
A3B8C17D20 |
52.32 |
8.23 |
-9.16 |
-1.32 |
0 |
|
|
420185 |
135111713 |
1 |
FO2N4C15H17 |
AB2C4D15E17 |
-62.22 |
3.59 |
-9.13 |
-0.48 |
0 |
|
|
420186 |
135111722 |
1 |
SN2O4C18H28 |
AB2C4D18E28 |
-168.04 |
7.61 |
-9.7 |
-0.43 |
0 |
|
|
420187 |
135111735 |
1 |
ClO2N4C15H21 |
AB2C4D15E21 |
-70.82 |
2.3 |
-9.28 |
0.2 |
0 |
|
|
420188 |
135111739 |
1 |
ClO3N4C18H23 |
AB3C4D18E23 |
-51.91 |
5.59 |
-8.98 |
-1.05 |
0 |
|
|
420189 |
135111741 |
1 |
O2F3N3C17H20 |
A2B3C3D17E20 |
-197.37 |
0.93 |
-8.92 |
-0.32 |
0 |
|
|
420190 |
135111745 |
1 |
S2O6N9C38H53 |
A2B6C9D38E53 |
-156.66 |
14.86 |
-8.18 |
-0.39 |
0 |
|
|
420193 |
135111759 |
1 |
NO4C20H29 |
AB4C20D29 |
-161.76 |
3.37 |
-8.57 |
0.29 |
0 |
|
|
420194 |
135111760 |
1 |
SO6N9C37H45 |
AB6C9D37E45 |
-156.11 |
14.93 |
-8.23 |
-1.25 |
0 |
|
|
420195 |
135111786 |
1 |
ON4C22H24 |
AB4C22D24 |
66.66 |
2.49 |
-9.04 |
-0.7 |
0 |
|
|
420197 |
135111790 |
1 |
SO6N10C39H56 |
AB6C10D39E56 |
-210.39 |
10.64 |
-8.18 |
-1.34 |
0 |
|
|
420198 |
135111793 |
1 |
F3O3N4C20H23 |
A3B3C4D20E23 |
-234.39 |
4.99 |
-9.15 |
-0.68 |
0 |
|
|
420199 |
135111794 |
1 |
NO4C19H27 |
AB4C19D27 |
-187.64 |
3.32 |
-9.71 |
0.03 |
0 |
|
|
420200 |
135111798 |
1 |
SN3O3C19H27 |
AB3C3D19E27 |
-99.61 |
3.86 |
-8.41 |
-0.06 |
0 |
|
|
420201 |
135111799 |
1 |
OSN4C13H22 |
ABC4D13E22 |
0.38 |
3.89 |
-8.72 |
-0.67 |
0 |
|
|
420203 |
135111814 |
1 |
O4N5C26H35 |
A4B5C26D35 |
-114.43 |
10.21 |
-9.33 |
-0.6 |
0 |
|
|
420204 |
135111816 |
1 |
O4N7C36H51 |
A4B7C36D51 |
-160.46 |
8.65 |
-8.56 |
-0.06 |
0 |
|
|
420205 |
135111827 |
1 |
SN7O7C39H49 |
AB7C7D39E49 |
-260.28 |
4.49 |
-9.28 |
-0.87 |
0 |
|
|
420206 |
135111833 |
1 |
O4N6C19H24 |
A4B6C19D24 |
-64.39 |
11.1 |
-9.59 |
-1.26 |
0 |
|
|
420207 |
135111834 |
1 |
N6O8C35H46 |
A6B8C35D46 |
-314.04 |
5.82 |
-8.84 |
-0.18 |
0 |
|
|
420208 |
135111835 |
1 |
N2O3C19H24 |
A2B3C19D24 |
-83.73 |
4.69 |
-9.21 |
0.08 |
0 |
|
|
420209 |
135111837 |
1 |
SN5O5C30H37 |
AB5C5D30E37 |
-70.38 |
7.84 |
-8.37 |
-1.52 |
0 |
|
|
420210 |
135111838 |
2 |
NO3C9H12 |
AB3C9D12 |
-212.68 |
3.13 |
-8.43 |
-0.36 |
0 |
|
|
420211 |
135111840 |
1 |
NSO5C18H25 |
ABC5D18E25 |
-208.11 |
5.32 |
-9.02 |
0.04 |
0 |
|
|
420212 |
135111861 |
1 |
ClN3O3C18H24 |
AB3C3D18E24 |
-111.42 |
2.07 |
-8.97 |
0.0 |
0 |
|
|
420213 |
135111862 |
1 |
S2N6O8C29H42 |
A2B6C8D29E42 |
-299.88 |
7.31 |
-8.55 |
-0.62 |
0 |
|
|
420214 |
135111873 |
1 |
ClNO4C15H16 |
ABC4D15E16 |
-138.08 |
4.12 |
-9.43 |
-0.43 |
0 |
|
|
420215 |
135111882 |
1 |
N3O3C20H25 |
A3B3C20D25 |
-3.62 |
4.09 |
-7.99 |
-0.43 |
0 |
|
|
420216 |
135111886 |
1 |
SN2O5C17H22 |
AB2C5D17E22 |
-178.54 |
6.38 |
-9.73 |
-1.32 |
0 |
|
|
420217 |
135111905 |
1 |
N2F3O3C19H23 |
A2B3C3D19E23 |
-283.84 |
3.16 |
-9.8 |
-0.73 |
0 |
|
|
420218 |
135111909 |
1 |
O2N3C17H27 |
A2B3C17D27 |
-69.68 |
7.33 |
-9.1 |
0.13 |
0 |
|
|
420219 |
135111911 |
1 |
SO2N4C18H24 |
AB2C4D18E24 |
-10.95 |
6.67 |
-9.2 |
-0.17 |
0 |
|
|
420220 |
135111912 |
1 |
OF3N6C18H21 |
AB3C6D18E21 |
-129.91 |
6.03 |
-8.9 |
-0.78 |
0 |
|
|
420221 |
135111915 |
1 |
NO2C21H31 |
AB2C21D31 |
-101.05 |
2.69 |
-9.18 |
0.4 |
0 |
|
|
420222 |
135111916 |
1 |
N2O5C21H26 |
A2B5C21D26 |
-132.72 |
6.66 |
-9.5 |
-0.57 |
0 |
|
|
420223 |
135111917 |
1 |
SN2O4C17H26 |
AB2C4D17E26 |
-164.69 |
4.02 |
-9.53 |
0.21 |
0 |
|
|
420224 |
135111940 |
1 |
N3O3C22H27 |
A3B3C22D27 |
-112.59 |
5.53 |
-9.27 |
-0.18 |
0 |
|
|
420225 |
135111941 |
1 |
N3O4C17H19 |
A3B4C17D19 |
-98.13 |
3.93 |
-9.29 |
-1.04 |
0 |
|
|
420226 |
135111943 |
1 |
ON3C18H23 |
AB3C18D23 |
-13.06 |
5.69 |
-8.49 |
-0.27 |
0 |
|
|
420227 |
135111944 |
1 |
ClNO3C18H24 |
ABC3D18E24 |
-138.13 |
6.09 |
-9.14 |
-0.25 |
0 |
|
|
420228 |
135111945 |
1 |
SO3N4C13H22 |
AB3C4D13E22 |
-102.96 |
3.35 |
-9.17 |
-0.27 |
0 |
|
|
420229 |
135111946 |
1 |
SO2N7C19H25 |
AB2C7D19E25 |
26.29 |
1.28 |
-8.77 |
-1.46 |
0 |
|
|
420230 |
135111973 |
2 |
ON3C8H11 |
AB3C8D11 |
-25.33 |
3.35 |
-9.5 |
-0.27 |
0 |
|
|
420231 |
135111974 |
1 |
N6O7C43H56 |
A6B7C43D56 |
-260.1 |
8.72 |
-8.56 |
-0.03 |
0 |
|
|
420232 |
135111976 |
1 |
O2N6C15H20 |
A2B6C15D20 |
-8.63 |
6.34 |
-8.65 |
-0.28 |
0 |
|
|
420233 |
135111977 |
1 |
ClON5C13H16 |
ABC5D13E16 |
58.56 |
5.12 |
-8.87 |
-0.73 |
0 |
|
|
420234 |
135111979 |
1 |
SN2O3C17H20 |
AB2C3D17E20 |
-83.5 |
4.67 |
-9.24 |
-0.32 |
0 |
|
|
420235 |
135111980 |
1 |
O2N3C15H19 |
A2B3C15D19 |
-2.36 |
3.56 |
-8.82 |
0.05 |
0 |
|
|
420236 |
135111984 |
1 |
SN5C13H21 |
AB5C13D21 |
63.05 |
4.52 |
-9.17 |
-0.59 |
0 |
|
|
420237 |
135112000 |
1 |
N3O5C19H25 |
A3B5C19D25 |
-130.75 |
2.34 |
-9.04 |
-0.77 |
0 |
|
|
420238 |
135112002 |
1 |
FN2O5C18H21 |
AB2C5D18E21 |
-188.12 |
2.14 |
-9.31 |
-1.41 |
0 |
|
|
420239 |
135112003 |
1 |
NO4C19H29 |
AB4C19D29 |
-170.64 |
2.86 |
-9.08 |
-0.27 |
0 |
|
|
420240 |
135112011 |
1 |
O2N4C21H26 |
A2B4C21D26 |
-25.04 |
2.99 |
-8.81 |
-0.77 |
0 |
|
|
420241 |
135112021 |
1 |
O3N4C21H22 |
A3B4C21D22 |
-50.71 |
8.57 |
-9.34 |
-1.13 |
0 |
|
|
420242 |
135112022 |
1 |
FO4N7C36H44 |
AB4C7D36E44 |
-189.27 |
7.05 |
-8.74 |
-0.28 |
0 |
|
|
420243 |
135112023 |
1 |
ClN4C11H17 |
AB4C11D17 |
17.71 |
2.35 |
-8.95 |
-0.5 |
0 |
|
|
420244 |
135112025 |
1 |
O2N5C18H27 |
A2B5C18D27 |
-34.82 |
3.27 |
-8.76 |
-0.2 |
0 |
|
|
420245 |
135112026 |
1 |
O6N8C35H40 |
A6B8C35D40 |
-101.28 |
16.26 |
-9.12 |
-0.7 |
0 |
|
|
420246 |
135112036 |
1 |
ClN2C19H29 |
AB2C19D29 |
-11.89 |
3.28 |
-8.52 |
-0.04 |
0 |
|
|
420247 |
135112047 |
1 |
O2N3C19H23 |
A2B3C19D23 |
-34.11 |
4.4 |
-8.39 |
0.06 |
0 |
|
|
420249 |
135112060 |
1 |
N2O5C19H34 |
A2B5C19D34 |
-266.78 |
3.72 |
-9.64 |
0.57 |
0 |
|
|
420250 |
135112065 |
1 |
O5N7C37H47 |
A5B7C37D47 |
-159.49 |
4.5 |
-9.19 |
-0.28 |
0 |
|
|
420251 |
135112094 |
2 |
ON2C9H11 |
AB2C9D11 |
-23.66 |
3.43 |
-8.65 |
-0.75 |
0 |
|
|
420252 |
135112095 |
1 |
O3N5C22H25 |
A3B5C22D25 |
-15.97 |
4.49 |
-9.13 |
-0.62 |
0 |
|
|
420253 |
135112098 |
1 |
FN2S2O5C14H21 |
AB2C2D5E14F21 |
-230.21 |
4.32 |
-9.69 |
-1.0 |
0 |
|
|
420254 |
135112100 |
1 |
ClFO5N6C28H32 |
ABC5D6E28F32 |
-176.0 |
3.2 |
-9.21 |
-0.69 |
0 |
|
|
420255 |
135112101 |
2 |
NSO2C8H11 |
ABC2D8E11 |
-137.51 |
6.94 |
-9.43 |
-1.1 |
0 |
|
|
420256 |
135112102 |
2 |
N3O3C19H24 |
A3B3C19D24 |
-234.47 |
2.02 |
-8.89 |
-1.5 |
0 |
|
|
420257 |
135112103 |
1 |
SO2N5C15H23 |
AB2C5D15E23 |
-62.45 |
6.51 |
-8.67 |
-0.05 |
0 |
|
|
420259 |
135112111 |
1 |
SO3N5C21H23 |
AB3C5D21E23 |
-1.5 |
5.18 |
-8.58 |
-0.65 |
0 |
|
|
420260 |
135112116 |
2 |
N2O2C7H9 |
A2B2C7D9 |
-81.84 |
9.05 |
-8.59 |
-0.57 |
0 |
|
|
420261 |
135112118 |
1 |
OSN3C21H23 |
ABC3D21E23 |
63.13 |
5.94 |
-8.54 |
-0.7 |
0 |
|
|
420262 |
135112122 |
1 |
ON6C22H34 |
AB6C22D34 |
-5.57 |
5.81 |
-8.04 |
0.64 |
0 |
|
|
420263 |
135112132 |
1 |
SO3N4C16H18 |
AB3C4D16E18 |
-62.88 |
5.87 |
-9.44 |
-0.73 |
0 |
|
|
420264 |
135112136 |
1 |
ClNO3C18H22 |
ABC3D18E22 |
-116.86 |
7.07 |
-9.06 |
-0.39 |
0 |
|
|
420265 |
135112140 |
1 |
N3O5C13H21 |
A3B5C13D21 |
-138.8 |
5.8 |
-9.99 |
-0.4 |
0 |
|
|
420266 |
135112141 |
1 |
SN3O3C18H21 |
AB3C3D18E21 |
-59.58 |
6.21 |
-9.13 |
-1.09 |
0 |
|
|
420267 |
135112142 |
1 |
O3N4C20H26 |
A3B4C20D26 |
-71.67 |
10.64 |
-9.27 |
-0.16 |
0 |
|
|
420268 |
135112143 |
1 |
N5C16H21 |
A5B16C21 |
73.05 |
6.34 |
-8.84 |
-0.53 |
0 |
|
|
420269 |
135112163 |
1 |
F3N6O7C37H47 |
A3B6C7D37E47 |
-452.64 |
13.16 |
-9.06 |
-0.27 |
0 |
|
|
420270 |
135112164 |
1 |
NF2O3C17H21 |
AB2C3D17E21 |
-233.9 |
6.12 |
-9.58 |
-0.48 |
0 |
|
|
420271 |
135112165 |
1 |
N4O4C21H28 |
A4B4C21D28 |
-167.47 |
6.04 |
-9.01 |
-0.09 |
0 |
|
|
420272 |
135112166 |
1 |
NO5C18H25 |
AB5C18D25 |
-215.49 |
5.17 |
-9.57 |
0.14 |
0 |
|
|
420273 |
135112175 |
1 |
N5O5C31H39 |
A5B5C31D39 |
-183.86 |
4.91 |
-9.34 |
-0.25 |
0 |
|
|
420274 |
135112180 |
1 |
O4N5C27H33 |
A4B5C27D33 |
-59.29 |
5.59 |
-8.76 |
-0.49 |
0 |
|
|
420275 |
135112182 |
1 |
SO3N4C16H20 |
AB3C4D16E20 |
-90.3 |
2.84 |
-9.22 |
-0.81 |
0 |
|
|
420276 |
135112194 |
1 |
OSN2C21H24 |
ABC2D21E24 |
13.47 |
6.08 |
-8.15 |
-0.8 |
0 |
|
|
420277 |
135112212 |
5 |
NOC7H9 |
ABC7D9 |
-193.49 |
5.24 |
-8.44 |
-0.27 |
0 |
|
|
420278 |
135112215 |
1 |
N3O3C21H25 |
A3B3C21D25 |
-101.49 |
5.31 |
-8.56 |
-0.4 |
0 |
|
|
420279 |
135112216 |
1 |
N2S2O5C15H22 |
A2B2C5D15E22 |
-165.25 |
2.37 |
-8.92 |
-1.22 |
0 |
|
|
420280 |
135112217 |
1 |
N2O3C18H32 |
A2B3C18D32 |
-156.66 |
2.86 |
-8.78 |
1.08 |
0 |
|
|
420281 |
135112218 |
1 |
FN3O4C21H28 |
AB3C4D21E28 |
-140.72 |
5.93 |
-9.08 |
-0.91 |
0 |
|
|
420282 |
135112231 |
1 |
SN2O2C19H22 |
AB2C2D19E22 |
-50.22 |
6.06 |
-8.4 |
-0.37 |
0 |
|
|
420283 |
135112232 |
1 |
ClON2C17H25 |
ABC2D17E25 |
-43.29 |
3.12 |
-8.71 |
-0.14 |
0 |
|
|
420284 |
135112243 |
1 |
O2N3C22H23 |
A2B3C22D23 |
-23.55 |
5.65 |
-9.23 |
-0.57 |
0 |
|
|
420285 |
135112251 |
2 |
NO2C9H13 |
AB2C9D13 |
-144.99 |
6.3 |
-8.82 |
0.07 |
0 |
|
|
420286 |
135112254 |
1 |
O2N5C17H23 |
A2B5C17D23 |
-43.56 |
8.64 |
-8.88 |
-0.21 |
0 |
|
|
420287 |
135112255 |
3 |
ON2C6H8 |
AB2C6D8 |
-54.2 |
6.17 |
-9.09 |
-0.82 |
0 |
|
|
420288 |
135112258 |
1 |
NSCl2O5C16H21 |
ABC2D5E16F21 |
-234.66 |
4.24 |
-9.9 |
-1.37 |
0 |