List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
29173 |
832147 |
1 |
NCl2O2H11C17 |
AB2C2D11E17 |
-10.19 |
3.76 |
-9.24 |
-1.63 |
0 |
|
|
29174 |
832152 |
3 |
NOH5C6 |
ABC5D6 |
17.85 |
3.95 |
-9.03 |
-0.81 |
0 |
|
|
29175 |
832155 |
2 |
ON2H7C8 |
AB2C7D8 |
57.75 |
1.48 |
-8.52 |
-0.7 |
0 |
|
|
29176 |
832158 |
1 |
N2O3C20H20 |
A2B3C20D20 |
-51.63 |
3.93 |
-8.45 |
-1.26 |
0 |
|
|
29177 |
832175 |
1 |
N2O2F3C16H19 |
A2B2C3D16E19 |
-220.1 |
5.13 |
-9.64 |
-0.21 |
0 |
|
|
29178 |
832196 |
2 |
N2O2C6H11 |
A2B2C6D11 |
-188.09 |
5.61 |
-9.93 |
0.05 |
0 |
|
|
29179 |
832197 |
2 |
N2O2C6H11 |
A2B2C6D11 |
-190.96 |
6.59 |
-9.92 |
0.12 |
0 |
|
|
29180 |
832199 |
4 |
NOC2H3 |
ABC2D3 |
-172.17 |
6.53 |
-10.6 |
-0.41 |
0 |
|
|
29181 |
832201 |
4 |
NOC2H3 |
ABC2D3 |
-171.71 |
5.48 |
-10.36 |
0.13 |
0 |
|
|
29182 |
832203 |
1 |
N4O5C11H14 |
A4B5C11D14 |
-217.09 |
3.89 |
-10.28 |
-0.62 |
0 |
|
|
29183 |
832220 |
1 |
SN3O4H11C15 |
AB3C4D11E15 |
-98.02 |
5.58 |
-9.27 |
-2.05 |
0 |
|
|
29184 |
832223 |
1 |
SN2O4C15H24 |
AB2C4D15E24 |
-155.99 |
7.6 |
-8.85 |
-0.24 |
0 |
|
|
29185 |
832231 |
1 |
N2S2O5C11H16 |
A2B2C5D11E16 |
-171.91 |
3.27 |
-9.96 |
-1.35 |
0 |
|
|
29186 |
832232 |
1 |
N2S2O5C11H16 |
A2B2C5D11E16 |
-171.08 |
6.97 |
-9.93 |
-1.31 |
0 |
|
|
29187 |
832235 |
1 |
ClNO4C18H18 |
ABC4D18E18 |
-128.32 |
1.46 |
-8.44 |
-0.37 |
0 |
|
|
29188 |
832244 |
2 |
N2O2C5H9 |
A2B2C5D9 |
-183.29 |
4.68 |
-10.0 |
0.24 |
0 |
|
|
29189 |
832246 |
2 |
N2O2C5H9 |
A2B2C5D9 |
-183.25 |
4.72 |
-10.02 |
0.25 |
0 |
|
|
29190 |
832250 |
2 |
N2O3C6H9 |
A2B3C6D9 |
-261.3 |
4.14 |
-9.96 |
0.12 |
0 |
|
|
29191 |
832255 |
4 |
NOC2H3 |
ABC2D3 |
-154.1 |
7.41 |
-10.3 |
-0.33 |
0 |
|
|
29192 |
832263 |
2 |
N2O2C5H9 |
A2B2C5D9 |
-182.19 |
3.38 |
-9.93 |
0.08 |
0 |
|
|
29193 |
832271 |
2 |
NOC7H7 |
ABC7D7 |
-28.14 |
5.9 |
-8.55 |
-0.31 |
0 |
|
|
29194 |
832273 |
2 |
ON2H6C7 |
AB2C6D7 |
66.37 |
7.25 |
-8.62 |
-0.5 |
0 |
|
|
29195 |
832277 |
1 |
N3O3C17H19 |
A3B3C17D19 |
12.93 |
3.38 |
-9.17 |
-1.5 |
0 |
|
|
29196 |
832286 |
1 |
SN4H16C18 |
AB4C16D18 |
102.05 |
3.38 |
-8.99 |
-1.25 |
0 |
|
|
29197 |
832287 |
1 |
ON5C17H23 |
AB5C17D23 |
22.91 |
1.72 |
-8.34 |
-0.56 |
0 |
|
|
29198 |
832288 |
1 |
O2N3C19H27 |
A2B3C19D27 |
-63.44 |
4.69 |
-8.01 |
-0.47 |
0 |
|
|
29199 |
832289 |
1 |
N2O2C17H22 |
A2B2C17D22 |
-72.38 |
7.17 |
-8.38 |
-0.36 |
0 |
|
|
29200 |
832299 |
1 |
ClN3O4H14C15 |
AB3C4D14E15 |
-46.35 |
4.44 |
-9.41 |
-1.01 |
0 |
|
|
29201 |
832301 |
1 |
O2N3C12H17 |
A2B3C12D17 |
-57.63 |
3.26 |
-8.45 |
0.09 |
0 |
|
|
29202 |
832302 |
1 |
N2O5H14C16 |
A2B5C14D16 |
-125.63 |
5.48 |
-9.36 |
-1.78 |
0 |
|
|
29203 |
832305 |
1 |
FSN2O2H15C17 |
ABC2D2E15F17 |
-28.03 |
2.79 |
-9.02 |
-0.94 |
0 |
|
|
29204 |
832306 |
1 |
ClNOC15H18 |
ABCD15E18 |
-46.99 |
5.08 |
-8.74 |
-0.38 |
0 |
|
|
29205 |
832308 |
1 |
OSN3C11H11 |
ABC3D11E11 |
-2.63 |
8.23 |
-8.92 |
-0.6 |
0 |
|
|
29206 |
832309 |
2 |
NO2H6C8 |
AB2C6D8 |
-72.55 |
5.13 |
-9.14 |
-1.67 |
0 |
|
|
29207 |
832314 |
1 |
N2O3H18C21 |
A2B3C18D21 |
-24.05 |
4.72 |
-8.72 |
-1.04 |
0 |
|
|
29208 |
832319 |
1 |
FSN2H19C20 |
ABC2D19E20 |
23.85 |
6.11 |
-8.04 |
-0.43 |
0 |
|
|
29209 |
832320 |
1 |
NOSC15H21 |
ABCD15E21 |
-28.69 |
6.03 |
-8.12 |
-0.18 |
0 |
|
|
29210 |
832329 |
1 |
SO2N3H15C19 |
AB2C3D15E19 |
30.88 |
3.49 |
-9.08 |
-1.19 |
0 |
|
|
29211 |
832338 |
1 |
N2O3H16C18 |
A2B3C16D18 |
-60.44 |
1.99 |
-9.14 |
-0.7 |
0 |
|
|
29212 |
832341 |
1 |
N2O3C20H20 |
A2B3C20D20 |
-76.9 |
4.29 |
-8.83 |
-0.6 |
0 |
|
|
29213 |
832344 |
1 |
SN3O3C17H19 |
AB3C3D17E19 |
-79.58 |
6.27 |
-9.39 |
-0.89 |
0 |
|
|
29214 |
832345 |
1 |
SN3O3C17H19 |
AB3C3D17E19 |
-76.21 |
6.98 |
-9.53 |
-0.99 |
0 |
|
|
29215 |
832379 |
1 |
S2N3C16H17 |
A2B3C16D17 |
44.84 |
2.04 |
-8.52 |
-1.05 |
0 |
|
|
29216 |
832380 |
1 |
NSO3H17C18 |
ABC3D17E18 |
-75.15 |
4.97 |
-8.96 |
-0.78 |
0 |
|
|
29217 |
832382 |
1 |
NO3C19H19 |
AB3C19D19 |
-89.35 |
4.06 |
-8.94 |
-0.13 |
0 |
|
|
29218 |
832384 |
1 |
OSN2C13H22 |
ABC2D13E22 |
-66.37 |
3.32 |
-8.92 |
-0.57 |
0 |
|
|
29219 |
832397 |
1 |
SO4C11H12 |
AB4C11D12 |
-127.68 |
5.19 |
-10.21 |
-0.93 |
0 |
|
|
29220 |
832398 |
1 |
NOC18H25 |
ABC18D25 |
-31.22 |
2.66 |
-8.94 |
0.26 |
0 |
|
|
29221 |
832408 |
1 |
OBr2C6H8 |
AB2C6D8 |
-24.5 |
1.9 |
-10.23 |
-1.03 |
0 |
|
|
29222 |
832409 |
1 |
ON3C20H29 |
AB3C20D29 |
-18.07 |
1.53 |
-8.87 |
-0.61 |
0 |
|
|
29223 |
832411 |
1 |
ON3C20H29 |
AB3C20D29 |
-20.52 |
1.36 |
-8.87 |
-0.61 |
0 |
|
|
29224 |
832413 |
1 |
NO3C13H15 |
AB3C13D15 |
-90.78 |
2.25 |
-8.17 |
-0.65 |
0 |
|
|
29225 |
832433 |
1 |
NO3C19H23 |
AB3C19D23 |
-89.82 |
4.43 |
-8.32 |
-0.21 |
0 |
|
|
29226 |
832441 |
1 |
ClNO3C19H22 |
ABC3D19E22 |
-98.33 |
3.57 |
-8.19 |
-0.53 |
0 |
|
|
29227 |
832446 |
1 |
SN2O2C16H18 |
AB2C2D16E18 |
-11.85 |
4.31 |
-8.95 |
-0.69 |
0 |
|
|
29228 |
832449 |
1 |
FOSN3H16C18 |
ABCD3E16F18 |
-10.91 |
0.98 |
-8.72 |
-1.25 |
0 |
|
|
29229 |
832450 |
1 |
ClNO3C19H22 |
ABC3D19E22 |
-101.1 |
6.31 |
-8.72 |
-0.29 |
0 |
|
|
29230 |
832452 |
1 |
BrNO3C14H20 |
ABC3D14E20 |
-124.32 |
6.58 |
-8.55 |
-0.18 |
0 |
|
|
29231 |
832453 |
1 |
ClN2O3H17C18 |
AB2C3D17E18 |
-36.8 |
3.37 |
-8.95 |
-0.88 |
0 |
|
|
29232 |
832461 |
1 |
ClNSO3C16H16 |
ABCD3E16F16 |
-81.53 |
3.91 |
-8.9 |
-0.63 |
0 |
|
|
29233 |
832477 |
1 |
N2O3C16H16 |
A2B3C16D16 |
-59.45 |
1.83 |
-9.85 |
-1.39 |
0 |
|
|
29234 |
832479 |
1 |
N2O2C17H18 |
A2B2C17D18 |
5.83 |
2.55 |
-8.9 |
-0.5 |
0 |
|
|
29235 |
832482 |
1 |
NO3C14H15 |
AB3C14D15 |
-71.34 |
5.19 |
-8.89 |
-0.32 |
0 |
|
|
29236 |
832483 |
1 |
ClNO2H12C13 |
ABC2D12E13 |
-40.35 |
3.17 |
-9.59 |
-0.46 |
0 |
|
|
29237 |
832484 |
1 |
ClO5H9C11 |
AB5C9D11 |
-159.65 |
5.41 |
-9.79 |
-1.74 |
0 |
|
|
29238 |
832485 |
1 |
ClO5H9C11 |
AB5C9D11 |
-164.93 |
6.69 |
-9.69 |
-1.4 |
0 |
|
|
29239 |
832486 |
1 |
ClO5H9C11 |
AB5C9D11 |
-160.28 |
7.34 |
-9.81 |
-1.76 |
0 |
|
|
29240 |
832491 |
1 |
BrS2H7C11 |
AB2C7D11 |
55.47 |
2.05 |
-8.55 |
-0.89 |
0 |
|
|
29241 |
832494 |
1 |
O5H12C16 |
A5B12C16 |
-132.01 |
2.2 |
-9.15 |
-0.95 |
0 |
|
|
29242 |
832504 |
2 |
NO2H8C9 |
AB2C8D9 |
-122.09 |
0.27 |
-9.0 |
-0.78 |
0 |
|
|
29243 |
832511 |
1 |
NO4H13C17 |
AB4C13D17 |
-93.23 |
7.55 |
-10.27 |
-1.52 |
0 |
|
|
29244 |
832513 |
1 |
NO3C17H25 |
AB3C17D25 |
-140.16 |
1.65 |
-8.89 |
0.25 |
0 |
|
|
29245 |
832542 |
1 |
OSN3H13C16 |
ABC3D13E16 |
42.0 |
3.26 |
-8.93 |
-0.9 |
0 |
|
|
29246 |
832553 |
1 |
FN2O2H15C17 |
AB2C2D15E17 |
-76.75 |
1.75 |
-8.22 |
-1.73 |
0 |
|
|
29247 |
832558 |
1 |
ON2H16C17 |
AB2C16D17 |
34.18 |
2.68 |
-8.53 |
-0.2 |
0 |