List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
374293 |
131326319 |
1 |
SF2O2H8C11 |
AB2C2D8E11 |
-156.93 |
4.02 |
-9.36 |
-1.24 |
0 |
|
|
374294 |
131326320 |
1 |
SF2O2H8C11 |
AB2C2D8E11 |
-155.32 |
6.61 |
-9.3 |
-1.34 |
0 |
|
|
374295 |
131326334 |
1 |
NOSC10H15 |
ABCD10E15 |
-23.03 |
0.87 |
-9.41 |
-0.53 |
0 |
|
|
374296 |
131326346 |
1 |
FN2C13H17 |
AB2C13D17 |
-32.87 |
2.98 |
-8.72 |
-0.32 |
0 |
|
|
374297 |
131326347 |
1 |
ON2C13H18 |
AB2C13D18 |
-30.68 |
4.27 |
-8.35 |
-0.02 |
0 |
|
|
374298 |
131326359 |
1 |
NCl2H5O5C8 |
AB2C5D5E8 |
-118.37 |
5.62 |
-10.57 |
-2.26 |
0 |
|
|
374299 |
131326360 |
1 |
NCl2H5O5C8 |
AB2C5D5E8 |
-119.44 |
5.64 |
-10.71 |
-2.2 |
0 |
|
|
374300 |
131326362 |
1 |
NCl2H5O5C8 |
AB2C5D5E8 |
-117.67 |
3.69 |
-10.39 |
-2.16 |
0 |
|
|
374301 |
131326363 |
1 |
NCl2H5O5C8 |
AB2C5D5E8 |
-121.95 |
4.17 |
-10.82 |
-2.3 |
0 |
|
|
374302 |
131326366 |
1 |
ON2C9H16 |
AB2C9D16 |
-11.11 |
3.28 |
-9.71 |
0.2 |
0 |
|
|
374303 |
131326373 |
2 |
NOC4H6 |
ABC4D6 |
-64.84 |
5.23 |
-9.77 |
0.3 |
0 |
|
|
374304 |
131326385 |
1 |
N4C11H14 |
A4B11C14 |
46.63 |
3.68 |
-9.41 |
-0.32 |
0 |
|
|
374305 |
131326401 |
1 |
BrNS2H4C9 |
ABC2D4E9 |
93.71 |
4.73 |
-9.42 |
-1.28 |
0 |
|
|
374306 |
131326442 |
1 |
INO2C9H10 |
ABC2D9E10 |
-33.45 |
4.31 |
-9.74 |
-1.27 |
0 |
|
|
374307 |
131326461 |
1 |
BrNO2C11H14 |
ABC2D11E14 |
-70.38 |
1.47 |
-8.69 |
-0.32 |
0 |
|
|
374308 |
131326499 |
1 |
BrON2H3C8 |
ABC2D3E8 |
80.88 |
4.08 |
-10.07 |
-1.74 |
0 |
|
|
374309 |
131326503 |
1 |
BrON2H3C8 |
ABC2D3E8 |
78.56 |
1.51 |
-10.2 |
-1.58 |
0 |
|
|
374310 |
131326567 |
1 |
N2O3C11H12 |
A2B3C11D12 |
-85.71 |
4.56 |
-9.92 |
-1.08 |
0 |
|
|
374311 |
131326580 |
1 |
O2S2C11H12 |
A2B2C11D12 |
-45.02 |
4.12 |
-8.27 |
-0.66 |
0 |
|
|
374312 |
131326584 |
1 |
O2S2C11H12 |
A2B2C11D12 |
-46.05 |
3.29 |
-8.36 |
-0.62 |
0 |
|
|
374313 |
131326591 |
1 |
NOH7C9 |
ABC7D9 |
23.59 |
3.61 |
-9.3 |
-0.88 |
0 |
|
|
374314 |
131326593 |
1 |
O2N3C11H19 |
A2B3C11D19 |
-97.62 |
4.14 |
-10.02 |
0.58 |
0 |
|
|
374315 |
131326607 |
1 |
NSO4H7C9 |
ABC4D7E9 |
-55.13 |
6.5 |
-9.49 |
-1.69 |
0 |
|
|
374316 |
131326614 |
1 |
NSO4H7C9 |
ABC4D7E9 |
-52.77 |
7.11 |
-9.12 |
-1.76 |
0 |
|
|
374317 |
131326665 |
1 |
BrOS2C11H11 |
ABC2D11E11 |
-1.59 |
3.31 |
-8.27 |
-0.8 |
0 |
|
|
374318 |
131326696 |
1 |
ON3C10H13 |
AB3C10D13 |
-7.68 |
1.0 |
-8.66 |
-0.21 |
0 |
|
|
374319 |
131326701 |
1 |
ON4C10H14 |
AB4C10D14 |
22.25 |
4.02 |
-8.71 |
-0.21 |
0 |
|
|
374320 |
131326704 |
1 |
ON4C10H14 |
AB4C10D14 |
42.23 |
2.72 |
-9.07 |
-0.8 |
0 |
|
|
374321 |
131326731 |
1 |
FSO3H7C10 |
ABC3D7E10 |
-125.02 |
6.4 |
-8.84 |
-1.21 |
0 |
|
|
374322 |
131326744 |
1 |
ClO5C9H9 |
AB5C9D9 |
-195.77 |
3.62 |
-9.95 |
-0.84 |
0 |
|
|
374323 |
131326748 |
1 |
ClFO3C10H10 |
ABC3D10E10 |
-173.81 |
0.82 |
-9.45 |
-0.56 |
0 |
|
|
374324 |
131326778 |
1 |
NSBr2O2H5C9 |
ABC2D2E5F9 |
38.25 |
5.6 |
-9.29 |
-1.64 |
0 |
|
|
374325 |
131326826 |
1 |
SO3C12H12 |
AB3C12D12 |
-98.47 |
4.47 |
-8.63 |
-0.83 |
0 |
|
|
374326 |
131326833 |
2 |
NC5H5 |
AB5C5 |
48.03 |
2.14 |
-8.7 |
0.16 |
0 |
|
|
374327 |
131326842 |
1 |
BrNSO3H8C10 |
ABCD3E8F10 |
-18.01 |
3.9 |
-9.36 |
-1.89 |
0 |
|
|
374328 |
131326844 |
1 |
BrNSO3H8C10 |
ABCD3E8F10 |
-9.95 |
4.77 |
-9.4 |
-1.71 |
0 |
|
|
374329 |
131326847 |
1 |
BrNSO3H8C10 |
ABCD3E8F10 |
-13.89 |
6.4 |
-9.34 |
-1.61 |
0 |
|
|
374330 |
131326863 |
1 |
BrNSO3H6C9 |
ABCD3E6F9 |
-10.34 |
6.85 |
-8.98 |
-1.94 |
0 |
|
|
374331 |
131326882 |
1 |
NSO2F3H6C9 |
ABC2D3E6F9 |
-207.3 |
2.79 |
-8.33 |
-0.93 |
0 |
|
|
374332 |
131326926 |
1 |
BrFN2O2H8C10 |
ABC2D2E8F10 |
-75.66 |
3.41 |
-9.26 |
-1.25 |
0 |
|
|
374333 |
131326927 |
1 |
BrFN2O2H8C10 |
ABC2D2E8F10 |
-62.16 |
4.34 |
-9.38 |
-1.16 |
0 |
|
|
374334 |
131326954 |
1 |
ClF2O3H5C9 |
AB2C3D5E9 |
-183.08 |
2.93 |
-10.25 |
-1.66 |
0 |
|
|
374335 |
131326962 |
1 |
OSN2C12H14 |
ABC2D12E14 |
2.18 |
4.16 |
-8.11 |
-0.68 |
0 |
|
|
374336 |
131326972 |
1 |
BrSO2C11H11 |
ABC2D11E11 |
-41.44 |
1.34 |
-8.01 |
-0.72 |
0 |
|
|
374337 |
131327001 |
1 |
BrClSO2H6C10 |
ABCD2E6F10 |
-44.66 |
3.55 |
-9.41 |
-1.54 |
0 |
|
|
374338 |
131327004 |
1 |
ISO3H7C11 |
ABC3D7E11 |
-47.98 |
3.99 |
-9.21 |
-1.52 |
0 |
|
|
374339 |
131327025 |
1 |
OF2N2H6C10 |
AB2C2D6E10 |
-62.24 |
7.01 |
-10.0 |
-1.54 |
0 |
|
|
374340 |
131327054 |
1 |
BrO4C11H11 |
AB4C11D11 |
-159.81 |
2.14 |
-10.35 |
-1.28 |
0 |
|
|
374341 |
131327088 |
1 |
IO2F3H6C9 |
AB2C3D6E9 |
-199.8 |
2.28 |
-10.11 |
-1.69 |
0 |
|
|
374342 |
131327097 |
1 |
IO2F3H6C9 |
AB2C3D6E9 |
-202.81 |
3.7 |
-10.34 |
-1.9 |
0 |
|
|
374343 |
131327103 |
1 |
BrO2N3C9H12 |
AB2C3D9E12 |
-62.91 |
5.63 |
-8.52 |
-0.63 |
0 |
|
|
374344 |
131327150 |
1 |
NOC12H13 |
ABC12D13 |
-7.53 |
6.06 |
-9.82 |
-0.79 |
0 |
|
|
374345 |
131327188 |
1 |
BrNSO2F3H5C7 |
ABCD2E3F5G7 |
-193.62 |
3.78 |
-9.41 |
-1.47 |
0 |
|
|
374346 |
131327206 |
1 |
BrH3N4C7 |
AB3C4D7 |
135.14 |
7.51 |
-9.81 |
-1.67 |
0 |
|
|
374347 |
131327216 |
1 |
BrNCl2O3H4C8 |
ABC2D3E4F8 |
-31.92 |
3.41 |
-10.51 |
-2.01 |
0 |
|
|
374348 |
131327228 |
1 |
BrN2O2F3H6C8 |
AB2C2D3E6F8 |
-215.67 |
5.88 |
-9.32 |
-1.34 |
0 |
|
|
374349 |
131327245 |
1 |
ON2F3C9H11 |
AB2C3D9E11 |
-166.41 |
2.99 |
-10.22 |
-0.79 |
0 |
|
|
374350 |
131327263 |
1 |
BrNSH8C10 |
ABCD8E10 |
57.31 |
1.95 |
-9.71 |
-0.78 |
0 |
|
|
374351 |
131327290 |
2 |
ON2C5H6 |
AB2C5D6 |
-54.96 |
6.38 |
-8.79 |
-0.43 |
0 |
|
|
374352 |
131327352 |
1 |
Cl2N4C9H12 |
A2B4C9D12 |
25.27 |
1.98 |
-8.97 |
-0.83 |
0 |
|
|
374353 |
131327364 |
2 |
NO2C5H6 |
AB2C5D6 |
-77.68 |
3.54 |
-9.85 |
-1.62 |
0 |
|
|
374354 |
131327370 |
1 |
ClON3C10H10 |
ABC3D10E10 |
18.39 |
10.77 |
-8.3 |
-0.98 |
0 |
|
|
374355 |
131327387 |
1 |
ClSN3H6C9 |
ABC3D6E9 |
85.66 |
5.83 |
-9.5 |
-1.72 |
0 |
|
|
374356 |
131327390 |
1 |
BrClNOH9C11 |
ABCDE9F11 |
-0.31 |
2.78 |
-10.26 |
-1.44 |
0 |
|
|
374357 |
131327403 |
1 |
ON4C11H12 |
AB4C11D12 |
54.0 |
4.54 |
-9.83 |
-1.88 |
0 |
|
|
374358 |
131327407 |
1 |
ClON3H8C10 |
ABC3D8E10 |
46.95 |
3.23 |
-9.59 |
-1.95 |
0 |
|
|
374359 |
131327414 |
1 |
FON3H10C11 |
ABC3D10E11 |
3.33 |
5.28 |
-9.6 |
-1.67 |
0 |
|
|
374360 |
131327415 |
1 |
BrFON2H8C11 |
ABCD2E8F11 |
-9.52 |
4.68 |
-9.59 |
-1.5 |
0 |
|
|
374361 |
131327429 |
1 |
NO2H9C10 |
AB2C9D10 |
-34.17 |
3.61 |
-9.38 |
-0.49 |
0 |
|
|
374362 |
131327436 |
1 |
BrN2O3H9C10 |
AB2C3D9E10 |
-15.61 |
7.83 |
-8.19 |
-1.43 |
0 |
|
|
374363 |
131327441 |
1 |
BrN2O3H9C10 |
AB2C3D9E10 |
-33.26 |
6.47 |
-8.53 |
-1.19 |
0 |
|
|
374364 |
131327450 |
1 |
NSO2C9H13 |
ABC2D9E13 |
-42.61 |
4.8 |
-9.25 |
-0.55 |
0 |
|
|
374365 |
131327456 |
1 |
BrOSN3C10H10 |
ABCD3E10F10 |
51.88 |
2.79 |
-9.14 |
-1.63 |
0 |
|
|
374366 |
131327466 |
1 |
BrFON3H7C9 |
ABCD3E7F9 |
-34.46 |
7.73 |
-9.56 |
-1.24 |
0 |
|
|
374367 |
131327469 |
1 |
BrFON2H8C10 |
ABCD2E8F10 |
-25.86 |
7.11 |
-9.56 |
-1.32 |
0 |
|
|
374368 |
131327486 |
1 |
NSO4C10H19 |
ABC4D10E19 |
-190.19 |
4.08 |
-9.69 |
0.28 |
0 |
|
|
374369 |
131327504 |
1 |
NF5H8C9 |
AB5C8D9 |
-223.87 |
2.87 |
-10.22 |
-0.8 |
0 |
|
|
374370 |
131327509 |
1 |
NCl2F2C9H9 |
AB2C2D9E9 |
-105.9 |
3.11 |
-9.74 |
-0.78 |
0 |
|
|
374371 |
131327547 |
1 |
BrSO2H9C11 |
ABC2D9E11 |
-25.62 |
0.94 |
-8.75 |
-1.5 |
0 |
|
|
374372 |
131327552 |
1 |
N2O2C11H14 |
A2B2C11D14 |
-34.54 |
3.28 |
-7.89 |
-0.1 |
0 |
|
|
374373 |
131327575 |
1 |
ClON2C12H13 |
ABC2D12E13 |
-16.36 |
3.96 |
-8.81 |
-0.24 |
0 |
|
|
374374 |
131327578 |
1 |
BrSO3H7C11 |
ABC3D7E11 |
-70.76 |
6.46 |
-9.36 |
-1.54 |
0 |
|
|
374375 |
131327579 |
1 |
BrSO3H7C11 |
ABC3D7E11 |
-70.6 |
6.58 |
-9.42 |
-1.56 |
0 |
|
|
374376 |
131327605 |
1 |
ClNSF3O3H11C12 |
ABCD3E3F11G12 |
-263.05 |
6.03 |
-10.59 |
-1.64 |
0 |
|
|
374377 |
131327664 |
1 |
ClNSH4O4C9 |
ABCD4E4F9 |
-45.87 |
5.19 |
-9.98 |
-2.26 |
0 |
|
|
374378 |
131327670 |
1 |
ClNSH4O4C9 |
ABCD4E4F9 |
-51.91 |
2.84 |
-9.85 |
-2.32 |
0 |
|
|
374379 |
131327680 |
1 |
BrNSO3H8C10 |
ABCD3E8F10 |
-15.96 |
5.11 |
-9.35 |
-1.94 |
0 |
|
|
374380 |
131327714 |
1 |
O2N3C11H17 |
A2B3C11D17 |
-45.9 |
4.67 |
-9.54 |
0.06 |
0 |
|
|
374381 |
131327754 |
1 |
N2C9H16 |
A2B9C16 |
0.12 |
4.4 |
-9.54 |
1.32 |
0 |
|
|
374382 |
131327780 |
1 |
ON2C11H12 |
AB2C11D12 |
3.28 |
5.6 |
-8.72 |
-0.18 |
0 |
|
|
374383 |
131327783 |
1 |
BrN2H9C10 |
AB2C9D10 |
47.63 |
5.93 |
-8.97 |
-0.79 |
0 |
|
|
374384 |
131327812 |
1 |
Cl2N3H5C7 |
A2B3C5D7 |
65.23 |
3.08 |
-9.29 |
-1.36 |
0 |
|
|
374385 |
131327818 |
1 |
BrNOC10H10 |
ABCD10E10 |
-21.23 |
1.37 |
-8.84 |
-0.44 |
0 |
|
|
374386 |
131327886 |
1 |
ClNSO2H6C11 |
ABCD2E6F11 |
-24.09 |
4.22 |
-9.62 |
-1.56 |
0 |
|
|
374387 |
131328027 |
1 |
ClSN2C12H19 |
ABC2D12E19 |
-7.82 |
7.03 |
-8.29 |
0.27 |
0 |
|
|
374388 |
131328100 |
1 |
BrOF2H9C10 |
ABC2D9E10 |
-129.61 |
3.39 |
-9.98 |
-0.96 |
0 |
|
|
374389 |
131328101 |
1 |
BrOF2H9C10 |
ABC2D9E10 |
-126.92 |
3.61 |
-9.83 |
-0.86 |
0 |
|
|
374390 |
131328102 |
1 |
BrOF2H9C10 |
ABC2D9E10 |
-128.86 |
2.38 |
-9.86 |
-1.0 |
0 |
|
|
374391 |
131328146 |
1 |
ON3C6H13 |
AB3C6D13 |
-57.21 |
6.15 |
-9.85 |
1.27 |
0 |
|
|
374392 |
131328149 |
1 |
OSN3C8H11 |
ABC3D8E11 |
-17.7 |
3.46 |
-8.36 |
-0.42 |
0 |