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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
72352 |
48416077 |
1 |
ON5C21H23 |
AB5C21D23 |
36.26 |
4.14 |
-8.82 |
-0.4 |
0 |
|
|
72353 |
48416078 |
2 |
ON2C10H10 |
AB2C10D10 |
13.72 |
7.38 |
-9.22 |
-0.66 |
0 |
|
|
72354 |
48416079 |
1 |
OSN5C14H15 |
ABC5D14E15 |
57.6 |
4.57 |
-9.16 |
-1.14 |
0 |
|
|
72355 |
48416080 |
1 |
NF2O5C21H23 |
AB2C5D21E23 |
-282.73 |
6.0 |
-8.73 |
-0.73 |
0 |
|
|
72356 |
48416081 |
1 |
NO6C23H29 |
AB6C23D29 |
-220.65 |
3.34 |
-8.63 |
-0.18 |
0 |
|
|
72357 |
48416082 |
2 |
NO2C10H12 |
AB2C10D12 |
-138.0 |
4.33 |
-8.86 |
-0.49 |
0 |
|
|
72358 |
48416083 |
1 |
NO5C23H31 |
AB5C23D31 |
-222.5 |
3.19 |
-8.94 |
-0.11 |
0 |
|
|
72359 |
48416084 |
1 |
N3O5C19H23 |
A3B5C19D23 |
-159.64 |
5.01 |
-9.08 |
-0.95 |
0 |
|
|
72360 |
48416085 |
1 |
N2O5C23H28 |
A2B5C23D28 |
-190.15 |
5.19 |
-8.66 |
0.01 |
0 |
|
|
72361 |
48416087 |
1 |
O2N4C23H26 |
A2B4C23D26 |
-31.08 |
5.16 |
-8.84 |
-0.26 |
0 |
|
|
72362 |
48416088 |
1 |
O3N5C22H23 |
A3B5C22D23 |
-70.45 |
7.58 |
-9.18 |
-1.06 |
0 |
|
|
72363 |
48416089 |
1 |
OSN5C14H15 |
ABC5D14E15 |
59.6 |
5.95 |
-9.19 |
-1.39 |
0 |
|
|
72364 |
48416090 |
1 |
NO5C20H25 |
AB5C20D25 |
-181.8 |
4.1 |
-8.93 |
-0.1 |
0 |
|
|
72365 |
48416091 |
1 |
N2O5C21H28 |
A2B5C21D28 |
-172.22 |
6.79 |
-8.45 |
0.15 |
0 |
|
|
72366 |
48416092 |
1 |
NO5C23H29 |
AB5C23D29 |
-194.17 |
6.79 |
-8.68 |
-0.08 |
0 |
|
|
72367 |
48416094 |
1 |
SN2O5C21H26 |
AB2C5D21E26 |
-180.09 |
3.44 |
-8.91 |
-0.74 |
0 |
|
|
72368 |
48416095 |
2 |
NO3C11H12 |
AB3C11D12 |
-212.6 |
2.96 |
-8.9 |
-0.92 |
0 |
|
|
72369 |
48416096 |
1 |
N3O4C21H23 |
A3B4C21D23 |
-99.6 |
6.63 |
-8.58 |
-0.77 |
0 |
|
|
72370 |
48416097 |
1 |
SN2O5C20H26 |
AB2C5D20E26 |
-202.8 |
1.09 |
-8.74 |
-0.36 |
0 |
|
|
72371 |
48416098 |
2 |
N2O2C9H11 |
A2B2C9D11 |
-120.58 |
4.42 |
-8.68 |
-0.98 |
0 |
|
|
72372 |
48416099 |
1 |
N2O5C19H22 |
A2B5C19D22 |
-183.67 |
8.46 |
-8.62 |
-1.16 |
0 |
|
|
72373 |
48416100 |
1 |
FNO5C23H28 |
ABC5D23E28 |
-235.92 |
1.86 |
-8.73 |
-0.16 |
0 |
|
|
72374 |
48416101 |
1 |
N2O4C23H26 |
A2B4C23D26 |
-120.21 |
5.66 |
-9.25 |
-0.69 |
0 |
|
|
72375 |
48416102 |
1 |
N3O4C21H29 |
A3B4C21D29 |
-148.74 |
3.76 |
-8.81 |
0.08 |
0 |
|
|
72376 |
48416103 |
1 |
N3O5C19H25 |
A3B5C19D25 |
-179.79 |
1.99 |
-8.81 |
-0.51 |
0 |
|
|
72377 |
48416104 |
1 |
NO4C21H29 |
AB4C21D29 |
-172.38 |
4.01 |
-8.71 |
0.22 |
0 |
|
|
72378 |
48416105 |
3 |
NO2C7H9 |
AB2C7D9 |
-201.03 |
5.46 |
-8.64 |
-1.12 |
0 |
|
|
72379 |
48416106 |
1 |
FN2O5C22H25 |
AB2C5D22E25 |
-227.79 |
3.8 |
-8.78 |
-0.92 |
0 |
|
|
72380 |
48416107 |
1 |
N3O6C20H23 |
A3B6C20D23 |
-141.04 |
5.67 |
-8.9 |
-1.77 |
0 |
|
|
72381 |
48416108 |
1 |
BrN2O4C18H21 |
AB2C4D18E21 |
-135.14 |
3.51 |
-8.76 |
-0.13 |
0 |
|
|
72382 |
48416109 |
1 |
SN2O5C19H26 |
AB2C5D19E26 |
-209.1 |
3.41 |
-8.76 |
-0.39 |
0 |
|
|
72383 |
48416112 |
1 |
N2O5C20H24 |
A2B5C20D24 |
-170.07 |
3.93 |
-8.89 |
-0.47 |
0 |
|
|
72384 |
48416113 |
1 |
SN2O5C18H24 |
AB2C5D18E24 |
-203.85 |
2.74 |
-8.62 |
-0.63 |
0 |
|
|
72385 |
48416114 |
1 |
NO5C19H23 |
AB5C19D23 |
-181.38 |
5.33 |
-8.58 |
-0.08 |
0 |
|
|
72386 |
48416115 |
1 |
NO4C22H27 |
AB4C22D27 |
-154.44 |
2.14 |
-8.58 |
0.03 |
0 |
|
|
72387 |
48416116 |
1 |
NO4C20H27 |
AB4C20D27 |
-162.09 |
4.44 |
-8.72 |
0.24 |
0 |
|
|
72388 |
48416117 |
1 |
NSO4C20H25 |
ABC4D20E25 |
-154.24 |
2.36 |
-8.67 |
-0.35 |
0 |
|
|
72389 |
48416118 |
1 |
N2O5C18H22 |
A2B5C18D22 |
-142.94 |
2.11 |
-8.77 |
-0.74 |
0 |
|
|
72390 |
48416121 |
1 |
FN2O5C22H25 |
AB2C5D22E25 |
-226.56 |
5.43 |
-8.7 |
-0.87 |
0 |
|
|
72391 |
48416122 |
1 |
FNO4C22H26 |
ABC4D22E26 |
-197.32 |
1.06 |
-8.67 |
-0.18 |
0 |
|
|
72392 |
48416123 |
1 |
SN2O5C19H24 |
AB2C5D19E24 |
-199.16 |
3.65 |
-8.64 |
-0.7 |
0 |
|
|
72393 |
48416124 |
1 |
NO6C23H29 |
AB6C23D29 |
-226.94 |
4.05 |
-8.58 |
0.2 |
0 |
|
|
72394 |
48416125 |
1 |
NCl2O4C18H23 |
AB2C4D18E23 |
-169.31 |
3.89 |
-8.76 |
0.05 |
0 |
|
|
72395 |
48416127 |
1 |
NSO4C20H25 |
ABC4D20E25 |
-143.18 |
5.28 |
-8.95 |
-0.15 |
0 |
|
|
72396 |
48416128 |
1 |
N2O4C23H24 |
A2B4C23D24 |
-107.23 |
5.95 |
-8.62 |
-1.13 |
0 |
|
|
72397 |
48416129 |
1 |
N3O6C21H25 |
A3B6C21D25 |
-153.35 |
7.78 |
-8.8 |
-1.02 |
0 |
|
|
72398 |
48416130 |
1 |
NO6C23H27 |
AB6C23D27 |
-213.9 |
3.63 |
-8.68 |
-0.41 |
0 |
|
|
72399 |
48416131 |
1 |
N3O4C23H25 |
A3B4C23D25 |
-88.35 |
2.8 |
-8.94 |
-1.04 |
0 |
|
|
72400 |
48416132 |
2 |
NO3C11H12 |
AB3C11D12 |
-211.58 |
1.95 |
-8.76 |
-0.74 |
0 |
|
|
72401 |
48416134 |
1 |
N2O4C21H26 |
A2B4C21D26 |
-138.64 |
2.53 |
-8.76 |
-0.28 |
0 |
|
|
72402 |
48416135 |
1 |
NF2O4C20H21 |
AB2C4D20E21 |
-228.32 |
3.78 |
-8.72 |
-1.0 |
0 |
|
|
72403 |
48416136 |
1 |
NSO4C18H21 |
ABC4D18E21 |
-129.94 |
2.37 |
-8.73 |
-0.57 |
0 |
|
|
72404 |
48416137 |
1 |
N2O5C22H26 |
A2B5C22D26 |
-189.33 |
5.55 |
-8.59 |
-0.43 |
0 |
|
|
72405 |
48416138 |
1 |
N2O5C23H32 |
A2B5C23D32 |
-225.42 |
5.58 |
-8.93 |
0.01 |
0 |
|
|
72406 |
48416139 |
1 |
N2O5C23H28 |
A2B5C23D28 |
-199.76 |
7.13 |
-8.64 |
0.0 |
0 |
|
|
72407 |
48416142 |
2 |
N2O2C10H11 |
A2B2C10D11 |
-74.68 |
4.35 |
-8.65 |
-1.27 |
0 |
|
|
72408 |
48416143 |
1 |
N2O7C21H24 |
A2B7C21D24 |
-180.87 |
3.43 |
-8.77 |
-1.21 |
0 |
|
|
72409 |
48416144 |
2 |
NO3C11H14 |
AB3C11D14 |
-223.42 |
4.75 |
-8.64 |
-0.38 |
0 |
|
|
72410 |
48416146 |
1 |
NO6C23H23 |
AB6C23D23 |
-200.95 |
5.3 |
-8.69 |
-1.6 |
0 |
|
|
72411 |
48416147 |
1 |
NO6C22H25 |
AB6C22D25 |
-205.71 |
3.81 |
-8.89 |
-0.02 |
0 |
|
|
72412 |
48416148 |
1 |
NO4C21H25 |
AB4C21D25 |
-145.59 |
4.26 |
-8.63 |
-0.28 |
0 |
|
|
72413 |
48416149 |
1 |
N2O6C21H24 |
A2B6C21D24 |
-150.21 |
3.68 |
-8.88 |
-1.55 |
0 |
|
|
72414 |
48416150 |
1 |
ClFNO4C20H21 |
ABCD4E20F21 |
-193.46 |
4.21 |
-8.89 |
-0.73 |
0 |
|
|
72415 |
48416151 |
1 |
SN2O4C20H24 |
AB2C4D20E24 |
-127.34 |
4.06 |
-8.79 |
-0.74 |
0 |
|
|
72416 |
48416152 |
1 |
N2O6C21H24 |
A2B6C21D24 |
-151.6 |
4.79 |
-8.7 |
-1.56 |
0 |
|
|
72417 |
48416153 |
1 |
NO5C22H27 |
AB5C22D27 |
-182.7 |
5.08 |
-8.74 |
0.13 |
0 |
|
|
72418 |
48416154 |
1 |
NO5C22H27 |
AB5C22D27 |
-188.26 |
4.11 |
-8.63 |
-0.01 |
0 |
|
|
72419 |
48416155 |
2 |
NO2C11H14 |
AB2C11D14 |
-140.79 |
3.94 |
-8.38 |
0.0 |
0 |
|
|
72420 |
48416157 |
1 |
NO5C22H27 |
AB5C22D27 |
-184.38 |
4.95 |
-8.47 |
-0.44 |
0 |
|
|
72421 |
48416159 |
1 |
N2O6C21H24 |
A2B6C21D24 |
-148.26 |
4.06 |
-8.69 |
-1.7 |
0 |
|
|
72422 |
48416160 |
1 |
NSO4C18H21 |
ABC4D18E21 |
-131.66 |
3.91 |
-8.75 |
-0.8 |
0 |
|
|
72423 |
48416161 |
1 |
N3O4C19H23 |
A3B4C19D23 |
-120.85 |
5.43 |
-8.7 |
-1.16 |
0 |
|
|
72424 |
48416162 |
1 |
NO6C22H27 |
AB6C22D27 |
-215.57 |
4.87 |
-8.54 |
-0.07 |
0 |
|
|
72425 |
48416163 |
1 |
NO4C19H29 |
AB4C19D29 |
-194.66 |
3.63 |
-8.73 |
0.22 |
0 |
|
|
72426 |
48416164 |
1 |
NF2O4C20H21 |
AB2C4D20E21 |
-229.61 |
6.1 |
-8.91 |
-0.71 |
0 |
|
|
72427 |
48416165 |
1 |
NO4C22H27 |
AB4C22D27 |
-153.69 |
6.96 |
-8.65 |
-0.13 |
0 |
|
|
72428 |
48416166 |
1 |
NO6C22H27 |
AB6C22D27 |
-208.31 |
4.83 |
-8.8 |
-0.1 |
0 |
|
|
72429 |
48416167 |
1 |
FNO5C21H24 |
ABC5D21E24 |
-224.49 |
4.32 |
-8.93 |
-0.12 |
0 |
|
|
72430 |
48416168 |
1 |
FNO5C21H24 |
ABC5D21E24 |
-220.01 |
4.86 |
-8.75 |
-0.45 |
0 |
|
|
72431 |
48416169 |
1 |
NO6C23H29 |
AB6C23D29 |
-218.99 |
4.02 |
-8.27 |
0.25 |
0 |
|
|
72432 |
48416170 |
1 |
NO6C22H27 |
AB6C22D27 |
-211.45 |
3.62 |
-8.44 |
-0.02 |
0 |
|
|
72433 |
48416171 |
1 |
NO4C18H25 |
AB4C18D25 |
-155.83 |
3.01 |
-8.75 |
0.18 |
0 |
|
|
72434 |
48416172 |
1 |
NO4C22H27 |
AB4C22D27 |
-156.05 |
3.5 |
-8.62 |
-0.09 |
0 |
|
|
72435 |
48416173 |
1 |
FNO4C21H24 |
ABC4D21E24 |
-191.56 |
1.53 |
-8.71 |
-0.24 |
0 |
|
|
72436 |
48416174 |
2 |
N2O2C11H12 |
A2B2C11D12 |
-77.25 |
3.28 |
-9.07 |
-1.28 |
0 |
|
|
72437 |
48416175 |
1 |
SN3O4C18H23 |
AB3C4D18E23 |
-114.29 |
4.27 |
-8.82 |
-1.43 |
0 |
|
|
72438 |
48416176 |
1 |
NO5C21H27 |
AB5C21D27 |
-202.11 |
3.35 |
-8.69 |
0.23 |
0 |
|
|
72439 |
48416177 |
1 |
ClN2O4C19H21 |
AB2C4D19E21 |
-131.98 |
3.49 |
-8.81 |
-0.94 |
0 |
|
|
72440 |
48416178 |
1 |
N2O6C21H24 |
A2B6C21D24 |
-148.17 |
6.9 |
-8.77 |
-1.24 |
0 |
|
|
72441 |
48416179 |
1 |
N2O5C23H34 |
A2B5C23D34 |
-237.49 |
5.1 |
-8.88 |
0.04 |
0 |
|
|
72442 |
48416180 |
2 |
N2O2C10H11 |
A2B2C10D11 |
-82.27 |
9.03 |
-8.51 |
-1.53 |
0 |
|
|
72443 |
48416181 |
1 |
N3O5C18H21 |
A3B5C18D21 |
-158.19 |
1.75 |
-8.84 |
-1.2 |
0 |
|
|
72444 |
48416182 |
1 |
NF2O5C21H23 |
AB2C5D21E23 |
-284.63 |
4.19 |
-8.86 |
-0.47 |
0 |
|
|
72445 |
48416183 |
1 |
N2O5C23H28 |
A2B5C23D28 |
-186.0 |
3.76 |
-8.66 |
-0.21 |
0 |
|
|
72446 |
48416184 |
1 |
NO5C19H23 |
AB5C19D23 |
-176.93 |
4.5 |
-8.86 |
-0.19 |
0 |
|
|
72447 |
48416185 |
1 |
NO6C23H27 |
AB6C23D27 |
-219.32 |
3.51 |
-8.67 |
-0.03 |
0 |
|
|
72448 |
48416186 |
1 |
NSO4C21H27 |
ABC4D21E27 |
-152.14 |
2.63 |
-8.72 |
-0.12 |
0 |
|
|
72449 |
48416187 |
1 |
N2O4C21H22 |
A2B4C21D22 |
-104.18 |
4.76 |
-9.04 |
-0.96 |
0 |
|
|
72450 |
48416188 |
1 |
FNO4C21H24 |
ABC4D21E24 |
-193.43 |
5.69 |
-9.05 |
-0.23 |
0 |
|
|
72451 |
48416189 |
1 |
NF2O4C20H21 |
AB2C4D20E21 |
-229.06 |
2.48 |
-8.66 |
-0.95 |
0 |