List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
267200 |
103581271 |
1 |
NF2O2C14H19 |
AB2C2D14E19 |
-173.03 |
2.91 |
-9.37 |
-0.62 |
0 |
|
|
267201 |
103581273 |
1 |
NCl2O3C15H21 |
AB2C3D15E21 |
-136.92 |
2.47 |
-9.22 |
-0.67 |
0 |
|
|
267202 |
103581282 |
1 |
N2O3C14H20 |
A2B3C14D20 |
-47.94 |
4.39 |
-9.57 |
-1.43 |
0 |
|
|
267203 |
103581284 |
1 |
NO2C12H25 |
AB2C12D25 |
-126.23 |
2.1 |
-9.01 |
2.26 |
0 |
|
|
267204 |
103581290 |
1 |
NO3C11H23 |
AB3C11D23 |
-147.35 |
4.49 |
-8.88 |
1.87 |
0 |
|
|
267205 |
103581294 |
1 |
ClFNOC13H17 |
ABCDE13F17 |
-92.66 |
2.71 |
-9.19 |
-0.5 |
0 |
|
|
267206 |
103581295 |
1 |
BrNOC9H16 |
ABCD9E16 |
-42.94 |
1.84 |
-9.33 |
-0.2 |
0 |
|
|
267207 |
103581305 |
1 |
N2O2C13H26 |
A2B2C13D26 |
-128.15 |
5.45 |
-9.1 |
1.23 |
0 |
|
|
267208 |
103581316 |
1 |
NCl2O3C15H21 |
AB2C3D15E21 |
-135.9 |
2.69 |
-9.03 |
-0.62 |
0 |
|
|
267209 |
103581330 |
1 |
NO2C11H23 |
AB2C11D23 |
-112.69 |
1.33 |
-8.99 |
2.3 |
0 |
|
|
267210 |
103581331 |
1 |
ClN2O3C13H17 |
AB2C3D13E17 |
-49.35 |
3.79 |
-9.5 |
-1.28 |
0 |
|
|
267211 |
103581332 |
1 |
NOC19H21 |
ABC19D21 |
-0.99 |
1.47 |
-8.68 |
-0.31 |
0 |
|
|
267212 |
103581347 |
1 |
N2O2C15H22 |
A2B2C15D22 |
-79.18 |
6.43 |
-9.13 |
-0.24 |
0 |
|
|
267213 |
103581366 |
4 |
NOC3H5 |
ABC3D5 |
-70.34 |
8.58 |
-9.85 |
-0.79 |
0 |
|
|
267214 |
103581367 |
1 |
N2O2C15H24 |
A2B2C15D24 |
-80.63 |
4.04 |
-9.03 |
-0.27 |
0 |
|
|
267215 |
103581371 |
1 |
BrN2O3C13H17 |
AB2C3D13E17 |
-36.54 |
6.2 |
-9.61 |
-1.58 |
0 |
|
|
267216 |
103581381 |
1 |
NOC17H25 |
ABC17D25 |
-51.03 |
3.36 |
-8.96 |
0.43 |
0 |
|
|
267217 |
103581382 |
2 |
NO2C7H10 |
AB2C7D10 |
-78.72 |
6.36 |
-9.39 |
-1.37 |
0 |
|
|
267218 |
103581390 |
1 |
NO3C12H23 |
AB3C12D23 |
-170.52 |
4.22 |
-9.27 |
0.81 |
0 |
|
|
267219 |
103581403 |
1 |
NOC15H23 |
ABC15D23 |
-45.36 |
2.23 |
-9.03 |
0.35 |
0 |
|
|
267220 |
103581404 |
1 |
NO2C18H29 |
AB2C18D29 |
-106.8 |
2.89 |
-9.14 |
0.14 |
0 |
|
|
267221 |
103581411 |
1 |
NO2C16H23 |
AB2C16D23 |
-82.78 |
3.36 |
-9.12 |
0.18 |
0 |
|
|
267222 |
103581413 |
1 |
NSO3C11H23 |
ABC3D11E23 |
-155.99 |
5.9 |
-9.13 |
1.0 |
0 |
|
|
267223 |
103581416 |
2 |
NOC6H11 |
ABC6D11 |
-106.84 |
4.43 |
-9.26 |
0.96 |
0 |
|
|
267224 |
103581419 |
1 |
FON2C14H17 |
ABC2D14E17 |
-48.58 |
5.08 |
-9.44 |
-0.94 |
0 |
|
|
267225 |
103581424 |
1 |
NO3C17H35 |
AB3C17D35 |
-186.85 |
3.25 |
-9.46 |
1.72 |
0 |
|
|
267226 |
103581426 |
1 |
NOC9H19 |
ABC9D19 |
-70.81 |
1.41 |
-8.99 |
2.21 |
0 |
|
|
267227 |
103581441 |
1 |
NO3C13H25 |
AB3C13D25 |
-174.48 |
4.38 |
-9.19 |
0.98 |
0 |
|
|
267228 |
103581442 |
1 |
ClNO3C15H22 |
ABC3D15E22 |
-130.05 |
3.72 |
-9.16 |
-0.14 |
0 |
|
|
267229 |
103581446 |
1 |
N2O2C13H26 |
A2B2C13D26 |
-126.29 |
4.77 |
-9.45 |
1.05 |
0 |
|
|
267230 |
103581447 |
1 |
NOC11H21 |
ABC11D21 |
-57.38 |
2.2 |
-9.22 |
1.13 |
0 |
|
|
267231 |
103581449 |
1 |
NOC11H21 |
ABC11D21 |
-61.16 |
2.56 |
-8.98 |
2.33 |
0 |
|
|
267232 |
103581450 |
1 |
NO3C15H23 |
AB3C15D23 |
-108.93 |
3.71 |
-8.38 |
0.23 |
0 |
|
|
267233 |
103581455 |
1 |
BrNF2O2C14H18 |
ABC2D2E14F18 |
-179.43 |
3.45 |
-9.24 |
-0.61 |
0 |
|
|
267234 |
103581471 |
1 |
BrClNOC11H15 |
ABCDE11F15 |
-30.96 |
4.13 |
-9.24 |
-0.3 |
0 |
|
|
267235 |
103581472 |
1 |
BrClN2C14H22 |
ABC2D14E22 |
4.22 |
2.94 |
-8.56 |
-0.42 |
0 |
|
|
267236 |
103581478 |
1 |
BrClNO2H13C15 |
ABCD2E13F15 |
-19.83 |
2.96 |
-8.82 |
-0.48 |
0 |
|
|
267237 |
103581479 |
1 |
BrClN2C13H20 |
ABC2D13E20 |
7.55 |
3.42 |
-8.78 |
-0.39 |
0 |
|
|
267238 |
103581480 |
1 |
BrClNOC15H15 |
ABCDE15F15 |
-1.47 |
3.54 |
-9.58 |
-0.52 |
0 |
|
|
267239 |
103581481 |
1 |
BrClFNH12C14 |
ABCDE12F14 |
-2.38 |
2.81 |
-9.49 |
-0.45 |
0 |
|
|
267240 |
103581482 |
1 |
BrClON2C15H18 |
ABCD2E15F18 |
15.11 |
2.11 |
-9.03 |
-0.55 |
0 |
|
|
267241 |
103581493 |
1 |
BrClN2C14H20 |
ABC2D14E20 |
7.53 |
5.07 |
-8.9 |
-0.28 |
0 |
|
|
267242 |
103581494 |
1 |
BrClON2C10H12 |
ABCD2E10F12 |
-24.08 |
2.48 |
-9.69 |
-0.65 |
0 |
|
|
267243 |
103581498 |
1 |
BrClNOF2H13C15 |
ABCDE2F13G15 |
-102.49 |
3.79 |
-9.45 |
-0.57 |
0 |
|
|
267244 |
103581499 |
1 |
BrClON2C11H14 |
ABCD2E11F14 |
-22.04 |
4.08 |
-9.39 |
-0.58 |
0 |
|
|
267245 |
103581506 |
1 |
BrClN2C14H20 |
ABC2D14E20 |
4.46 |
4.47 |
-8.76 |
-0.43 |
0 |
|
|
267246 |
103581508 |
1 |
BrClN2C16H18 |
ABC2D16E18 |
44.95 |
3.49 |
-8.19 |
-0.4 |
0 |
|
|
267247 |
103581525 |
1 |
BrClNOF3C11H12 |
ABCDE3F11G12 |
-182.48 |
4.43 |
-9.56 |
-0.49 |
0 |
|
|
267248 |
103581526 |
1 |
BrClSN2O2C11H16 |
ABCD2E2F11G16 |
-69.03 |
4.06 |
-9.51 |
-0.49 |
0 |
|
|
267249 |
103581527 |
1 |
BrClNOC16H17 |
ABCDE16F17 |
0.09 |
2.77 |
-9.41 |
-0.49 |
0 |