List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
159995 |
57304352 |
1 |
ClON3C24H34 |
ABC3D24E34 |
12.87 |
2.76 |
-8.44 |
-0.36 |
0 |
|
|
159996 |
57304355 |
2 |
NO3C21H28 |
AB3C21D28 |
-232.29 |
2.15 |
-8.5 |
-0.52 |
0 |
|
|
159997 |
57304358 |
1 |
ClOSN2H13C15 |
ABCD2E13F15 |
46.87 |
5.83 |
-8.78 |
-1.31 |
0 |
|
|
159998 |
57304359 |
1 |
ON2C8H12 |
AB2C8D12 |
25.39 |
1.72 |
-8.67 |
-0.89 |
0 |
|
|
159999 |
57304360 |
1 |
S2N7C10H15 |
A2B7C10D15 |
103.12 |
7.66 |
-9.16 |
-0.84 |
0 |
|
|
160000 |
57304367 |
1 |
N3O3F9H22C24 |
A3B3C9D22E24 |
-583.89 |
6.04 |
-9.53 |
-1.42 |
0 |
|
|
160001 |
57304368 |
1 |
ClSO2C9H9 |
ABC2D9E9 |
-80.18 |
6.43 |
-9.22 |
-0.68 |
0 |
|
|
160004 |
57304371 |
1 |
NO2C18H23 |
AB2C18D23 |
-61.54 |
1.08 |
-8.76 |
0.07 |
0 |
|
|
160005 |
57304372 |
1 |
ClN3O3C9H10 |
AB3C3D9E10 |
-38.5 |
5.84 |
-9.42 |
-1.32 |
0 |
|
|
160006 |
57304373 |
1 |
OSCl2C8H8 |
ABC2D8E8 |
-28.08 |
3.49 |
-9.43 |
-0.64 |
0 |
|
|
160007 |
57304374 |
1 |
NO5C10H11 |
AB5C10D11 |
-198.58 |
0.53 |
-9.35 |
-0.58 |
0 |
|
|
160008 |
57304375 |
1 |
SN2Cl3O5C12H15 |
AB2C3D5E12F15 |
-186.21 |
5.11 |
-9.29 |
-0.75 |
0 |
|
|
160009 |
57304376 |
1 |
O6N7C24H25 |
A6B7C24D25 |
-135.81 |
4.82 |
-9.12 |
-1.16 |
0 |
|
|
160010 |
57304378 |
1 |
FOH11C13 |
ABC11D13 |
-45.5 |
1.85 |
-9.16 |
-0.02 |
0 |
|
|
160011 |
57304379 |
1 |
NO2C27H33 |
AB2C27D33 |
-59.02 |
7.5 |
-9.05 |
-0.7 |
-1 |
|
|
160012 |
57304380 |
1 |
NSO4H6C7 |
ABC4D6E7 |
-113.86 |
7.5 |
0.0 |
0.0 |
0 |
|
|
160013 |
57304381 |
1 |
NSO4C7H7 |
ABC4D7E7 |
-130.79 |
7.06 |
-9.08 |
-0.88 |
0 |
|
|
160015 |
57304384 |
2 |
O2C6H13 |
A2B6C13 |
-247.19 |
0.62 |
-9.89 |
1.6 |
0 |
|
|
160016 |
57304385 |
1 |
BrNOH10C11 |
ABCD10E11 |
-19.33 |
2.62 |
-9.1 |
-1.06 |
0 |
|
|
160018 |
57304387 |
1 |
NOC19H19 |
ABC19D19 |
6.81 |
3.87 |
-8.72 |
-0.72 |
0 |
|
|
160019 |
57304388 |
1 |
NO2C7H11 |
AB2C7D11 |
-47.45 |
7.46 |
-10.38 |
0.09 |
0 |
|
|
160020 |
57304389 |
2 |
N2C5H5 |
A2B5C5 |
70.15 |
3.71 |
-8.65 |
-0.46 |
0 |
|
|
160021 |
57304390 |
1 |
O4C15H22 |
A4B15C22 |
-168.92 |
4.62 |
-8.45 |
-0.02 |
0 |
|
|
160022 |
57304391 |
1 |
SN3O4C23H31 |
AB3C4D23E31 |
-112.37 |
5.84 |
-9.02 |
-0.15 |
-1 |
|
|
160023 |
57304392 |
1 |
SCl4N5O11C37H42 |
AB4C5D11E37F42 |
-420.12 |
8.77 |
0.0 |
0.0 |
0 |
|
|
160024 |
57304394 |
1 |
N4O5C33H44 |
A4B5C33D44 |
-186.42 |
1.95 |
-9.14 |
-0.36 |
0 |
|
|
160025 |
57304395 |
1 |
NO4C24H39 |
AB4C24D39 |
-189.52 |
4.63 |
-9.52 |
-0.24 |
0 |
|
|
160028 |
57304398 |
1 |
SiO6C51H72 |
AB6C51D72 |
-310.77 |
4.57 |
-8.55 |
0.32 |
0 |
|
|
160029 |
57304399 |
1 |
ON3C8H9 |
AB3C8D9 |
20.63 |
3.6 |
-9.54 |
-0.74 |
0 |
|
|
160030 |
57304401 |
1 |
O2N5C27H35 |
A2B5C27D35 |
-42.62 |
1.69 |
-8.45 |
-0.31 |
0 |
|
|
160031 |
57304405 |
1 |
ClO2H15C16 |
AB2C15D16 |
-55.11 |
3.07 |
-9.52 |
-0.57 |
0 |
|
|
160032 |
57304406 |
1 |
FNSO3C18H18 |
ABCD3E18F18 |
-118.93 |
6.6 |
-9.58 |
-0.71 |
0 |
|
|
160033 |
57304407 |
2 |
O2N3C14H15 |
A2B3C14D15 |
-44.97 |
9.32 |
-8.44 |
-0.55 |
0 |
|
|
160035 |
57304410 |
1 |
SN2O5H18C20 |
AB2C5D18E20 |
-137.36 |
8.53 |
-9.7 |
-1.78 |
0 |
|
|
160036 |
57304411 |
2 |
OC16H17 |
AB16C17 |
-10.3 |
0.88 |
-8.78 |
0.04 |
0 |
|
|
160039 |
57304414 |
1 |
OSN3C22H29 |
ABC3D22E29 |
-2.36 |
5.93 |
-8.56 |
-0.51 |
0 |
|
|
160040 |
57304415 |
1 |
IO4N5H24C28 |
AB4C5D24E28 |
12.7 |
2.03 |
-9.44 |
-1.56 |
0 |
|
|
160041 |
57304419 |
1 |
N4O5H20C26 |
A4B5C20D26 |
-2.47 |
4.73 |
-8.42 |
-1.54 |
0 |
|
|
160043 |
57304423 |
2 |
NSO4C5H8 |
ABC4D5E8 |
-357.48 |
7.26 |
-9.94 |
-0.83 |
0 |
|
|
160044 |
57304426 |
1 |
BrO2C10H15 |
AB2C10D15 |
-109.78 |
5.65 |
-10.67 |
-0.87 |
1 |
|
|
160045 |
57304458 |
1 |
SN2O3C10H19 |
AB2C3D10E19 |
-166.6 |
2.08 |
0.0 |
0.0 |
0 |
|
|
160046 |
57304478 |
1 |
SO2N4C21H24 |
AB2C4D21E24 |
8.74 |
2.53 |
-8.26 |
-0.63 |
0 |
|
|
160049 |
57304495 |
1 |
NO3C8H17 |
AB3C8D17 |
-177.97 |
3.5 |
-10.46 |
0.81 |
0 |
|
|
160050 |
57304496 |
1 |
ON3C6H11 |
AB3C6D11 |
-27.19 |
3.46 |
-9.44 |
0.47 |
0 |
|
|
160051 |
57304508 |
1 |
Cl2N2F3O3H9C13 |
A2B2C3D3E9F13 |
-225.9 |
2.43 |
-9.39 |
-1.46 |
0 |
|
|
160052 |
57304510 |
1 |
Cl2F3N3O3H14C15 |
A2B3C3D3E14F15 |
-243.46 |
3.94 |
-9.28 |
-0.87 |
0 |
|
|
160053 |
57304512 |
1 |
O2N5C31H33 |
A2B5C31D33 |
29.87 |
7.71 |
-8.58 |
-0.68 |
0 |
|
|
160056 |
57304516 |
1 |
FIN2C11H14 |
ABC2D11E14 |
-16.34 |
3.86 |
-8.52 |
-0.89 |
0 |
|
|
160057 |
57304517 |
1 |
ClS2O3N6C18H19 |
AB2C3D6E18F19 |
-39.73 |
2.89 |
-8.85 |
-1.32 |
0 |
|
|
160058 |
57304521 |
1 |
OC8H12 |
AB8C12 |
13.38 |
2.65 |
-9.53 |
0.22 |
0 |