List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
163354 |
57837875 |
3 |
NOC10H11 |
ABC10D11 |
-71.69 |
7.17 |
-8.28 |
-0.53 |
0 |
|
|
163355 |
57840814 |
1 |
OCl2N4H18C19 |
AB2C4D18E19 |
5.73 |
5.86 |
-8.52 |
-0.87 |
0 |
|
|
163357 |
57841333 |
1 |
NO4C31H31 |
AB4C31D31 |
-85.35 |
2.01 |
-8.73 |
-1.09 |
0 |
|
|
163358 |
57841336 |
1 |
ClFNO4H23C32 |
ABCD4E23F32 |
-76.61 |
2.43 |
-9.07 |
-0.9 |
0 |
|
|
163359 |
57841337 |
1 |
ClNO4H24C31 |
ABC4D24E31 |
-41.07 |
7.55 |
-9.09 |
-1.12 |
0 |
|
|
163361 |
57841344 |
1 |
NO3C33H43 |
AB3C33D43 |
-103.42 |
6.17 |
-9.09 |
-0.55 |
0 |
|
|
163362 |
57842415 |
1 |
N5O5C34H49 |
A5B5C34D49 |
-197.6 |
6.78 |
-9.34 |
0.1 |
0 |
|
|
163363 |
57847124 |
1 |
O2N3C32H35 |
A2B3C32D35 |
-40.64 |
1.52 |
-8.54 |
-0.22 |
0 |
|
|
163364 |
57855005 |
1 |
SO2N3H19C23 |
AB2C3D19E23 |
28.37 |
4.14 |
-8.86 |
-0.91 |
0 |
|
|
163365 |
57886867 |
1 |
F2O4N6H22C25 |
A2B4C6D22E25 |
-119.21 |
8.49 |
-9.29 |
-1.29 |
0 |
|
|
163366 |
57887426 |
1 |
NO3C10H13 |
AB3C10D13 |
-39.03 |
3.61 |
-9.95 |
-1.29 |
0 |
|
|
163367 |
57894321 |
1 |
NF3H12C18 |
AB3C12D18 |
-76.85 |
3.94 |
-8.97 |
-1.09 |
0 |
|
|
163369 |
57896950 |
1 |
N7C26H31 |
A7B26C31 |
105.04 |
3.82 |
-8.81 |
-0.89 |
0 |
|
|
163370 |
57896960 |
1 |
O3N4C27H28 |
A3B4C27D28 |
-22.01 |
8.41 |
-8.63 |
-0.58 |
0 |
|
|
163371 |
57897220 |
1 |
BrON7C22H22 |
ABC7D22E22 |
101.32 |
6.63 |
-9.14 |
-1.0 |
0 |
|
|
163373 |
57898862 |
1 |
ClO3N4H17C22 |
AB3C4D17E22 |
-10.13 |
3.3 |
-9.09 |
-1.06 |
0 |
|
|
163374 |
57898907 |
1 |
ON3C17H29 |
AB3C17D29 |
-31.88 |
2.48 |
-8.47 |
1.01 |
0 |
|
|
163375 |
57899027 |
1 |
N2O5C17H18 |
A2B5C17D18 |
-150.83 |
6.77 |
-9.15 |
-0.29 |
0 |
|
|
163376 |
57900234 |
1 |
ClSN4O4C27H27 |
ABC4D4E27F27 |
-88.13 |
2.93 |
-9.04 |
-1.27 |
0 |
|
|
163377 |
57900929 |
1 |
ClO2N4C25H25 |
AB2C4D25E25 |
-33.82 |
3.92 |
-8.58 |
-0.56 |
0 |
|
|
163378 |
57900930 |
1 |
SN3O3C25H27 |
AB3C3D25E27 |
-64.64 |
7.0 |
-8.56 |
-0.56 |
0 |
|
|
163379 |
57900938 |
2 |
ON2C12H12 |
AB2C12D12 |
-11.76 |
5.07 |
-8.61 |
-0.58 |
0 |
|
|
163380 |
57900959 |
2 |
ON2C12H12 |
AB2C12D12 |
-19.93 |
2.14 |
-8.54 |
-0.44 |
0 |
|
|
163381 |
57903686 |
1 |
O3C35H38 |
A3B35C38 |
-77.48 |
1.07 |
-8.9 |
-0.28 |
0 |
|
|
163383 |
57907023 |
1 |
N4O4H8C15 |
A4B4C8D15 |
41.3 |
2.71 |
-10.1 |
-2.31 |
0 |
|
|
163384 |
57911741 |
1 |
ClF2N4H5C11 |
AB2C4D5E11 |
18.91 |
2.26 |
-9.79 |
-1.69 |
0 |
|
|
163385 |
57920689 |
2 |
NOC13H18 |
ABC13D18 |
-75.23 |
6.88 |
-8.0 |
0.1 |
0 |
|
|
163386 |
57922652 |
2 |
OC14H18 |
AB14C18 |
-99.52 |
5.31 |
-8.99 |
-0.5 |
0 |
|
|
163392 |
57929473 |
1 |
BNO3C8H16 |
ABC3D8E16 |
-212.67 |
3.06 |
-9.41 |
0.6 |
0 |
|
|
163393 |
57929474 |
1 |
SN3O3C16H23 |
AB3C3D16E23 |
-117.13 |
6.27 |
-8.95 |
-0.88 |
0 |
|
|
163394 |
57929548 |
1 |
NSO3C19H23 |
ABC3D19E23 |
-94.46 |
4.26 |
-8.81 |
-0.34 |
0 |
|
|
163395 |
57929600 |
1 |
SCl2O3N4C15H16 |
AB2C3D4E15F16 |
-73.1 |
3.36 |
-8.64 |
-1.12 |
0 |
|
|
163397 |
57929659 |
1 |
N2O3C31H44 |
A2B3C31D44 |
-148.11 |
5.11 |
-9.06 |
0.15 |
0 |
|
|
163398 |
57931366 |
1 |
ON3C5H9 |
AB3C5D9 |
-38.35 |
3.51 |
-9.58 |
1.08 |
0 |
|
|
163400 |
57935789 |
1 |
O2N3C31H45 |
A2B3C31D45 |
-70.86 |
4.09 |
-7.87 |
0.01 |
0 |
|
|
163401 |
57935790 |
1 |
SO2N3C28H33 |
AB2C3D28E33 |
-12.78 |
4.13 |
-7.91 |
-0.78 |
0 |
|
|
163402 |
57935792 |
1 |
N3O3C30H43 |
A3B3C30D43 |
-109.0 |
5.37 |
-8.2 |
0.06 |
0 |
|
|
163404 |
57936652 |
1 |
NO3C20H33 |
AB3C20D33 |
-117.41 |
6.69 |
-8.75 |
0.05 |
0 |
|
|
163405 |
57936654 |
1 |
NO5C20H29 |
AB5C20D29 |
-183.6 |
8.44 |
-9.64 |
-0.02 |
0 |
|
|
163406 |
57936660 |
1 |
N2O14C41H50 |
A2B14C41D50 |
-522.9 |
7.61 |
-8.6 |
-0.39 |
0 |
|
|
163408 |
57936819 |
2 |
N2H10C15 |
A2B10C15 |
162.51 |
3.05 |
-7.67 |
-1.14 |
0 |
|
|
163410 |
57937117 |
1 |
ClON4H11C18 |
ABC4D11E18 |
81.54 |
9.48 |
-8.76 |
-1.72 |
0 |
|
|
163411 |
57937160 |
1 |
NOH17C18 |
ABC17D18 |
13.06 |
4.89 |
-8.35 |
-0.5 |
0 |
|
|
163412 |
57937221 |
1 |
N2O2H32C41 |
A2B2C32D41 |
91.05 |
8.58 |
-8.44 |
-1.38 |
0 |
|
|
163414 |
57938137 |
1 |
O4C29H52 |
A4B29C52 |
-265.19 |
4.56 |
-9.55 |
0.95 |
0 |
|
|
163415 |
57939028 |
1 |
F2N2O5C24H30 |
A2B2C5D24E30 |
-302.33 |
3.43 |
-9.53 |
-0.9 |
0 |
|
|
163416 |
57939330 |
1 |
O2N3H17C18 |
A2B3C17D18 |
-0.73 |
3.76 |
-8.89 |
-0.91 |
0 |
|
|
163417 |
57939353 |
1 |
FINOH15C18 |
ABCDE15F18 |
-8.4 |
3.19 |
-8.54 |
-0.81 |
0 |
|
|
163419 |
57939436 |
1 |
O2N3F7C26H28 |
A2B3C7D26E28 |
-426.05 |
5.96 |
-9.43 |
-1.65 |
0 |
|
|
163421 |
57939458 |
1 |
O2N3F7H28C30 |
A2B3C7D28E30 |
-391.56 |
6.55 |
-9.56 |
-1.04 |
0 |