List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
33137 |
7885098 |
1 |
N2O4C17H24 |
A2B4C17D24 |
-176.4 |
5.58 |
-9.44 |
-0.32 |
0 |
|
|
33138 |
7885107 |
2 |
NO2C10H14 |
AB2C10D14 |
-189.84 |
7.01 |
-9.62 |
-0.36 |
0 |
|
|
33139 |
7885111 |
1 |
N3O5C23H25 |
A3B5C23D25 |
-143.79 |
5.5 |
-9.26 |
-0.41 |
0 |
|
|
33140 |
7885112 |
1 |
N2O5C21H22 |
A2B5C21D22 |
-177.33 |
5.96 |
-9.16 |
-0.74 |
0 |
|
|
33141 |
7885133 |
1 |
ClFN2O4C20H20 |
ABC2D4E20F20 |
-197.17 |
5.7 |
-9.24 |
-0.68 |
0 |
|
|
33142 |
7885143 |
1 |
NO6C18H19 |
AB6C18D19 |
-203.97 |
4.4 |
-9.51 |
-0.88 |
0 |
|
|
33143 |
7885145 |
1 |
NO4C21H23 |
AB4C21D23 |
-139.75 |
5.72 |
-9.36 |
-0.45 |
0 |
|
|
33144 |
7885148 |
1 |
N2O5C20H20 |
A2B5C20D20 |
-170.24 |
9.35 |
-9.48 |
-0.92 |
0 |
|
|
33145 |
7885152 |
1 |
N2O5C21H24 |
A2B5C21D24 |
-180.84 |
6.13 |
-8.62 |
-0.25 |
0 |
|
|
33146 |
7885154 |
2 |
NO2C10H11 |
AB2C10D11 |
-141.17 |
3.63 |
-8.87 |
-0.28 |
0 |
|
|
33147 |
7885157 |
1 |
N2O5C19H22 |
A2B5C19D22 |
-175.16 |
4.06 |
-9.54 |
-0.31 |
0 |
|
|
33148 |
7885167 |
1 |
NO4C23H27 |
AB4C23D27 |
-159.16 |
4.05 |
-9.24 |
-0.15 |
0 |
|
|
33149 |
7885168 |
1 |
N2O6C21H22 |
A2B6C21D22 |
-215.06 |
9.45 |
-9.41 |
-0.98 |
0 |
|
|
33150 |
7885178 |
1 |
N2O4C21H24 |
A2B4C21D24 |
-152.45 |
5.96 |
-8.74 |
-0.32 |
0 |
|
|
33151 |
7885186 |
1 |
N2O3C14H16 |
A2B3C14D16 |
-91.93 |
2.88 |
-9.53 |
-0.26 |
0 |
|
|
33152 |
7885187 |
1 |
N3O5C18H25 |
A3B5C18D25 |
-218.42 |
8.02 |
-9.41 |
-0.31 |
0 |
|
|
33153 |
7885189 |
1 |
SN2O3C16H18 |
AB2C3D16E18 |
-91.94 |
6.07 |
-9.46 |
-0.64 |
0 |
|
|
33154 |
7885195 |
1 |
N2O5C21H24 |
A2B5C21D24 |
-184.61 |
4.75 |
-8.83 |
-0.31 |
0 |
|
|
33155 |
7885196 |
1 |
N3O4C21H21 |
A3B4C21D21 |
-105.66 |
6.43 |
-9.51 |
-0.97 |
0 |
|
|
33156 |
7885197 |
1 |
N3O4C21H21 |
A3B4C21D21 |
-107.3 |
6.0 |
-9.47 |
-0.97 |
0 |
|
|
33157 |
7885199 |
1 |
N3O4C23H25 |
A3B4C23D25 |
-111.65 |
2.56 |
-9.4 |
-0.37 |
0 |
|
|
33158 |
7885204 |
1 |
N2F3O4H19C20 |
A2B3C4D19E20 |
-272.4 |
7.0 |
-9.45 |
-0.9 |
0 |
|
|
33159 |
7885211 |
1 |
ClN2O4C20H21 |
AB2C4D20E21 |
-154.35 |
6.87 |
-8.76 |
-0.43 |
0 |
|
|
33160 |
7885216 |
1 |
N3O4C21H21 |
A3B4C21D21 |
-111.97 |
9.89 |
-9.36 |
-0.82 |
0 |
|
|
33161 |
7885226 |
1 |
N2O4C21H30 |
A2B4C21D30 |
-199.29 |
6.75 |
-9.56 |
-0.3 |
0 |
|
|
33162 |
7885229 |
1 |
SN2O6C20H28 |
AB2C6D20E28 |
-260.49 |
6.57 |
-9.55 |
-0.33 |
0 |
|
|
33163 |
7885234 |
1 |
N3O4C19H23 |
A3B4C19D23 |
-121.12 |
10.23 |
-9.73 |
-0.51 |
0 |
|
|
33164 |
7885241 |
1 |
N3O4C20H25 |
A3B4C20D25 |
-149.21 |
5.35 |
-9.62 |
-0.42 |
0 |
|
|
33165 |
7885247 |
1 |
N3O4C20H27 |
A3B4C20D27 |
-157.95 |
8.52 |
-9.53 |
-0.23 |
0 |
|
|
33166 |
7885250 |
1 |
NO3C20H23 |
AB3C20D23 |
-113.48 |
3.96 |
-9.08 |
-0.09 |
0 |
|
|
33167 |
7885252 |
1 |
NCl2O3H17C18 |
AB2C3D17E18 |
-112.09 |
2.25 |
-9.49 |
-0.72 |
0 |
|
|
33168 |
7885254 |
2 |
NO2C11H16 |
AB2C11D16 |
-202.16 |
4.0 |
-9.55 |
-0.28 |
0 |
|
|
33169 |
7885257 |
2 |
NO2C11H16 |
AB2C11D16 |
-202.16 |
6.17 |
-9.58 |
-0.32 |
0 |
|
|
33170 |
7885261 |
3 |
NO2C7H9 |
AB2C7D9 |
-258.88 |
5.74 |
-9.44 |
-0.56 |
0 |
|
|
33171 |
7885263 |
1 |
NCl2O4C19H19 |
AB2C4D19E19 |
-148.22 |
5.61 |
-9.48 |
-0.62 |
0 |
|
|
33172 |
7885265 |
1 |
NO4C19H21 |
AB4C19D21 |
-135.96 |
2.07 |
-9.01 |
-0.14 |
0 |
|
|
33173 |
7885271 |
1 |
N2O4C13H16 |
A2B4C13D16 |
-161.94 |
3.41 |
-9.6 |
-0.4 |
0 |
|
|
33174 |
7885273 |
1 |
BrNO3C18H18 |
ABC3D18E18 |
-94.05 |
5.21 |
-9.49 |
-0.44 |
0 |
|
|
33175 |
7885274 |
1 |
NO4C14H17 |
AB4C14D17 |
-159.01 |
5.22 |
-9.51 |
-0.34 |
0 |
|
|
33176 |
7885275 |
1 |
ClNO3C18H18 |
ABC3D18E18 |
-105.98 |
2.96 |
-9.49 |
-0.43 |
0 |
|
|
33177 |
7885276 |
1 |
ClNO3C18H18 |
ABC3D18E18 |
-105.98 |
2.53 |
-9.44 |
-0.42 |
0 |
|
|
33178 |
7885277 |
1 |
NCl2O3H17C18 |
AB2C3D17E18 |
-114.46 |
3.88 |
-9.54 |
-0.76 |
0 |
|
|
33179 |
7885278 |
1 |
ClFNO3H17C18 |
ABCD3E17F18 |
-151.22 |
3.42 |
-9.47 |
-0.66 |
0 |
|
|
33180 |
7885284 |
2 |
NO2C11H13 |
AB2C11D13 |
-144.79 |
7.49 |
-9.44 |
-0.33 |
0 |
|
|
33181 |
7885285 |
2 |
NO2C10H11 |
AB2C10D11 |
-128.97 |
6.69 |
-8.93 |
-0.36 |
0 |
|
|
33182 |
7885289 |
2 |
NO2C10H14 |
AB2C10D14 |
-182.24 |
6.51 |
-9.35 |
-0.02 |
0 |
|
|
33183 |
7885293 |
1 |
N2O4C21H24 |
A2B4C21D24 |
-133.3 |
5.18 |
-9.39 |
-0.06 |
0 |
|
|
33184 |
7885294 |
2 |
NO2C10H14 |
AB2C10D14 |
-177.08 |
4.38 |
-9.37 |
-0.11 |
0 |
|
|
33185 |
7885296 |
1 |
N2O4C21H24 |
A2B4C21D24 |
-148.04 |
3.82 |
-8.96 |
-0.13 |
0 |
|
|
33186 |
7885301 |
2 |
NO2C10H11 |
AB2C10D11 |
-145.73 |
4.84 |
-8.88 |
-0.39 |
0 |
|
|
33187 |
7885304 |
1 |
ClN2O4C20H21 |
AB2C4D20E21 |
-153.63 |
4.38 |
-8.95 |
-0.45 |
0 |
|
|
33188 |
7885307 |
2 |
NO2C10H11 |
AB2C10D11 |
-144.1 |
6.18 |
-8.63 |
-0.29 |
0 |
|
|
33189 |
7885311 |
1 |
N2O5C20H22 |
A2B5C20D22 |
-174.43 |
8.24 |
-8.3 |
-0.45 |
0 |
|
|
33190 |
7885333 |
1 |
FN2O4C21H23 |
AB2C4D21E23 |
-182.14 |
6.95 |
-9.35 |
-0.25 |
0 |
|
|
33191 |
7885336 |
1 |
ClN2O4C19H19 |
AB2C4D19E19 |
-144.39 |
6.87 |
-9.14 |
-0.47 |
0 |
|
|
33192 |
7885337 |
1 |
N2O4C21H30 |
A2B4C21D30 |
-195.73 |
7.26 |
-9.63 |
-0.36 |
0 |
|
|
33193 |
7885353 |
1 |
N2O4C21H24 |
A2B4C21D24 |
-153.0 |
7.29 |
-8.54 |
-0.34 |
0 |
|
|
33194 |
7885355 |
1 |
N2O4C21H24 |
A2B4C21D24 |
-144.01 |
6.61 |
-9.61 |
-0.47 |
0 |
|
|
33195 |
7885359 |
1 |
SO3N4C17H18 |
AB3C4D17E18 |
-44.1 |
5.25 |
-8.62 |
-0.9 |
0 |
|
|
33196 |
7885361 |
1 |
SO3N4C17H20 |
AB3C4D17E20 |
-94.83 |
1.79 |
-8.97 |
-1.32 |
0 |
|
|
33197 |
7885362 |
2 |
NO3C11H12 |
AB3C11D12 |
-225.19 |
10.07 |
-9.73 |
-0.53 |
0 |
|
|
33198 |
7885364 |
1 |
SO3N4C16H20 |
AB3C4D16E20 |
-115.13 |
4.8 |
-8.63 |
-0.9 |
0 |
|
|
33199 |
7885365 |
2 |
NO3C11H12 |
AB3C11D12 |
-228.47 |
6.43 |
-9.4 |
-0.79 |
0 |
|
|
33200 |
7885366 |
1 |
SO3N4C16H20 |
AB3C4D16E20 |
-117.53 |
1.6 |
-8.95 |
-1.3 |
0 |
|
|
33201 |
7885375 |
2 |
NO2C11H13 |
AB2C11D13 |
-160.37 |
2.91 |
-8.88 |
-0.27 |
0 |
|
|
33202 |
7885377 |
1 |
SN3O3C22H27 |
AB3C3D22E27 |
-95.44 |
8.41 |
-8.37 |
-0.59 |
0 |
|
|
33203 |
7885385 |
2 |
NO3C11H12 |
AB3C11D12 |
-226.99 |
8.86 |
-9.37 |
-0.97 |
0 |
|
|
33204 |
7885386 |
1 |
SO2N3C19H25 |
AB2C3D19E25 |
-82.74 |
3.71 |
-8.76 |
-1.03 |
0 |
|
|
33205 |
7885389 |
1 |
SO2N3C19H25 |
AB2C3D19E25 |
-83.6 |
4.5 |
-8.71 |
-0.96 |
0 |
|
|
33206 |
7885391 |
1 |
SO2N3C19H25 |
AB2C3D19E25 |
-82.25 |
4.55 |
-8.67 |
-0.92 |
0 |
|
|
33207 |
7885394 |
1 |
SO2N3C22H25 |
AB2C3D22E25 |
-34.81 |
7.21 |
-8.4 |
-0.63 |
0 |
|
|
33208 |
7885395 |
1 |
N3O6C19H19 |
A3B6C19D19 |
-138.53 |
5.43 |
-9.64 |
-1.41 |
0 |
|
|
33209 |
7885396 |
1 |
BrClO2C19H22 |
ABC2D19E22 |
-88.17 |
1.61 |
-9.22 |
-0.6 |
0 |
|
|
33210 |
7885400 |
1 |
SO2N3C17H17 |
AB2C3D17E17 |
-27.9 |
2.96 |
-8.6 |
-0.86 |
0 |
|
|
33211 |
7885407 |
1 |
BrNSO4H16C17 |
ABCD4E16F17 |
-110.14 |
2.19 |
-9.48 |
-1.44 |
0 |
|
|
33212 |
7885416 |
1 |
SN4O4C19H20 |
AB4C4D19E20 |
-116.35 |
2.63 |
-8.98 |
-1.33 |
0 |
|
|
33213 |
7885421 |
1 |
N3O5C22H25 |
A3B5C22D25 |
-172.22 |
7.98 |
-9.22 |
-0.4 |
0 |
|
|
33214 |
7885423 |
1 |
N3O5C18H25 |
A3B5C18D25 |
-228.46 |
3.06 |
-9.53 |
-0.4 |
0 |
|
|
33215 |
7885426 |
1 |
SN2O4C21H22 |
AB2C4D21E22 |
-113.82 |
8.21 |
-8.44 |
-0.67 |
0 |
|
|
33216 |
7885431 |
1 |
N3O5C21H23 |
A3B5C21D23 |
-181.21 |
4.13 |
-9.59 |
-0.41 |
0 |
|
|
33217 |
7885438 |
1 |
SN2O4C22H22 |
AB2C4D22E22 |
-97.24 |
7.62 |
-9.16 |
-1.04 |
0 |
|
|
33218 |
7885453 |
1 |
SN2O3H18C19 |
AB2C3D18E19 |
-61.21 |
0.65 |
-8.69 |
-0.98 |
0 |
|
|
33219 |
7885465 |
1 |
SN3O3C23H29 |
AB3C3D23E29 |
-100.84 |
9.43 |
-8.34 |
-0.54 |
0 |
|
|
33220 |
7885466 |
1 |
N2O5C19H26 |
A2B5C19D26 |
-213.63 |
3.62 |
-9.42 |
-0.25 |
0 |
|
|
33221 |
7885468 |
1 |
N2O5C19H26 |
A2B5C19D26 |
-213.97 |
2.93 |
-9.43 |
-0.21 |
0 |
|
|
33222 |
7885475 |
1 |
FSO2N3C21H22 |
ABC2D3E21F22 |
-95.9 |
4.3 |
-8.92 |
-1.23 |
0 |
|
|
33223 |
7885483 |
2 |
NO2C10H14 |
AB2C10D14 |
-180.73 |
5.02 |
-9.41 |
-0.12 |
0 |
|
|
33224 |
7885484 |
1 |
SN3O3C22H25 |
AB3C3D22E25 |
-81.83 |
5.02 |
-8.7 |
-0.96 |
0 |
|
|
33225 |
7885497 |
1 |
NSO3C19H21 |
ABC3D19E21 |
-94.7 |
5.07 |
-8.85 |
-0.55 |
0 |
|
|
33226 |
7885503 |
1 |
N3O4C21H27 |
A3B4C21D27 |
-140.2 |
9.88 |
-9.51 |
-0.18 |
0 |
|
|
33227 |
7885508 |
1 |
SN3O3C23H29 |
AB3C3D23E29 |
-99.82 |
8.38 |
-8.36 |
-0.58 |
0 |
|
|
33228 |
7885511 |
1 |
ClSO2N3C20H20 |
ABC2D3E20F20 |
-51.28 |
4.6 |
-8.96 |
-1.26 |
0 |
|
|
33229 |
7885517 |
1 |
N4O4C19H24 |
A4B4C19D24 |
-124.14 |
4.07 |
-9.58 |
-0.56 |
0 |
|
|
33230 |
7885533 |
1 |
BrSO2N3H14C16 |
ABC2D3E14F16 |
-29.85 |
5.25 |
-9.11 |
-1.38 |
0 |
|
|
33231 |
7885536 |
1 |
NO3F5H14C18 |
AB3C5D14E18 |
-312.29 |
5.25 |
-9.58 |
-1.47 |
0 |
|
|
33232 |
7885547 |
1 |
SO2N3C13H15 |
AB2C3D13E15 |
-41.18 |
3.6 |
-9.0 |
-1.25 |
0 |
|
|
33233 |
7885548 |
1 |
ClN3O5C20H22 |
AB3C5D20E22 |
-169.58 |
7.36 |
-9.31 |
-0.83 |
0 |
|
|
33234 |
7885562 |
1 |
SO2N3C17H23 |
AB2C3D17E23 |
-80.97 |
4.16 |
-8.77 |
-0.98 |
0 |
|
|
33235 |
7885565 |
1 |
SO2N3C17H23 |
AB2C3D17E23 |
-77.63 |
4.2 |
-8.65 |
-0.84 |
0 |
|
|
33236 |
7885566 |
1 |
FN2O5C22H25 |
AB2C5D22E25 |
-227.25 |
8.38 |
-9.31 |
-0.59 |
0 |