List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
201395 |
79533199 |
1 |
BrSN2C12H15 |
ABC2D12E15 |
26.02 |
4.38 |
-8.7 |
-0.64 |
0 |
|
|
201396 |
79533200 |
1 |
BrClSN3C13H15 |
ABCD3E13F15 |
41.98 |
4.72 |
-8.86 |
-0.65 |
0 |
|
|
201397 |
79533708 |
1 |
BrNSC17H20 |
ABCD17E20 |
20.14 |
3.34 |
-8.66 |
-0.41 |
0 |
|
|
201398 |
79534173 |
1 |
BrSN3C13H16 |
ABC3D13E16 |
42.48 |
2.58 |
-8.85 |
-0.78 |
0 |
|
|
201399 |
79534434 |
1 |
BrN3O3C10H14 |
AB3C3D10E14 |
-33.13 |
8.75 |
-9.54 |
-1.35 |
0 |
|
|
201400 |
79534854 |
1 |
BrClFON2H7C11 |
ABCDE2F7G11 |
-23.18 |
4.84 |
-8.8 |
-0.79 |
0 |
|
|
201401 |
79534987 |
1 |
BrO2N4C8H11 |
AB2C4D8E11 |
23.33 |
8.99 |
-9.48 |
-1.31 |
0 |
|
|
201402 |
79535016 |
1 |
BrN3C13H18 |
AB3C13D18 |
26.6 |
2.14 |
-7.91 |
-0.29 |
0 |
|
|
201403 |
79535041 |
1 |
BrN3O3C12H14 |
AB3C3D12E14 |
-21.33 |
5.7 |
-9.48 |
-1.74 |
0 |
|
|
201404 |
79535042 |
1 |
BrSN2O4C10H11 |
ABC2D4E10F11 |
-54.95 |
4.81 |
-9.47 |
-2.18 |
0 |
|
|
201405 |
79535478 |
1 |
BrON2C10H15 |
ABC2D10E15 |
-26.43 |
2.27 |
-8.5 |
-0.5 |
0 |
|
|
201406 |
79535747 |
1 |
N2O2F3C14H21 |
A2B2C3D14E21 |
-270.28 |
3.25 |
-9.41 |
0.42 |
0 |
|
|
201407 |
79535982 |
1 |
NO2C18H25 |
AB2C18D25 |
-101.04 |
3.46 |
-9.21 |
0.13 |
0 |
|
|
201408 |
79535983 |
1 |
BrNS2O3C14H18 |
ABC2D3E14F18 |
-96.4 |
5.7 |
-9.66 |
-1.3 |
0 |
|
|
201409 |
79536389 |
1 |
FON3C16H22 |
ABC3D16E22 |
-82.15 |
6.77 |
-8.36 |
-0.13 |
0 |
|
|
201410 |
79536406 |
1 |
O2N3C16H25 |
A2B3C16D25 |
-52.8 |
6.39 |
-9.22 |
-0.41 |
0 |
|
|
201411 |
79536537 |
1 |
NOC12H21 |
ABC12D21 |
-72.38 |
3.22 |
-9.15 |
0.69 |
0 |
|
|
201412 |
79536538 |
1 |
NOC13H23 |
ABC13D23 |
-77.32 |
3.15 |
-9.17 |
0.69 |
0 |
|
|
201413 |
79536573 |
1 |
NOSC12H17 |
ABCD12E17 |
-23.89 |
2.79 |
-8.96 |
-0.65 |
0 |
|
|
201414 |
79536745 |
1 |
N3C17H25 |
A3B17C25 |
26.04 |
6.43 |
-8.79 |
-0.61 |
0 |
|
|
201415 |
79537014 |
2 |
N2C7H13 |
A2B7C13 |
12.88 |
1.63 |
-8.62 |
0.7 |
0 |
|
|
201416 |
79537151 |
1 |
ClSN4C15H19 |
ABC4D15E19 |
52.54 |
5.44 |
-8.06 |
-1.26 |
0 |
|
|
201417 |
79537152 |
3 |
NC6H11 |
AB6C11 |
-35.97 |
2.64 |
-8.57 |
2.84 |
0 |
|
|
201418 |
79537689 |
1 |
OSN6C12H12 |
ABC6D12E12 |
124.27 |
4.11 |
-8.94 |
-1.54 |
0 |
|
|
201419 |
79537868 |
1 |
N2F3C15H27 |
A2B3C15D27 |
-203.53 |
2.14 |
-8.7 |
1.59 |
0 |
|
|
201420 |
79538254 |
1 |
NO3C17H27 |
AB3C17D27 |
-105.91 |
1.08 |
-8.67 |
0.31 |
0 |
|
|
201421 |
79538255 |
1 |
NO5C15H27 |
AB5C15D27 |
-258.94 |
10.99 |
-10.15 |
0.6 |
0 |
|
|
201422 |
79538361 |
1 |
BrNS2O3C12H18 |
ABC2D3E12F18 |
-112.76 |
2.65 |
-9.5 |
-1.25 |
0 |
|
|
201423 |
79538378 |
1 |
O2N3C16H25 |
A2B3C16D25 |
-81.46 |
4.09 |
-8.3 |
-0.14 |
0 |
|
|
201424 |
79538502 |
1 |
N2O3C16H30 |
A2B3C16D30 |
-172.19 |
1.72 |
-9.1 |
1.33 |
0 |
|
|
201425 |
79538818 |
1 |
NF3O3C14H16 |
AB3C3D14E16 |
-259.03 |
4.66 |
-9.7 |
-1.02 |
0 |
|
|
201426 |
79539038 |
1 |
NO2F3C15H18 |
AB2C3D15E18 |
-245.56 |
6.83 |
-9.55 |
-0.82 |
0 |
|
|
201427 |
79539459 |
1 |
ClNSO3C15H18 |
ABCD3E15F18 |
-111.03 |
3.12 |
-9.56 |
-0.79 |
0 |
|
|
201428 |
79539593 |
1 |
N2O2C17H24 |
A2B2C17D24 |
-63.66 |
1.02 |
-8.07 |
0.09 |
0 |
|
|
201429 |
79539594 |
1 |
SN2O2C11H24 |
AB2C2D11E24 |
-110.48 |
5.43 |
-8.91 |
0.96 |
0 |
|
|
201430 |
79539595 |
1 |
N3C16H23 |
A3B16C23 |
31.61 |
6.59 |
-8.81 |
-0.6 |
0 |
|
|
201431 |
79539600 |
1 |
N3C16H33 |
A3B16C33 |
-36.23 |
1.12 |
-8.41 |
2.9 |
0 |
|
|
201432 |
79540671 |
2 |
N2C8H11 |
A2B8C11 |
50.98 |
2.52 |
-8.57 |
-0.34 |
0 |
|
|
201433 |
79540982 |
1 |
NO2C17H23 |
AB2C17D23 |
-94.73 |
3.92 |
-9.1 |
0.36 |
0 |
|
|
201434 |
79540983 |
1 |
BrNO3C12H14 |
ABC3D12E14 |
-93.85 |
4.39 |
-9.53 |
-0.9 |
0 |
|
|
201435 |
79540984 |
1 |
O2N3C13H19 |
A2B3C13D19 |
-66.88 |
5.87 |
-9.25 |
0.31 |
0 |
|
|
201436 |
79540985 |
1 |
NO3C13H17 |
AB3C13D17 |
-112.63 |
4.67 |
-9.3 |
-0.22 |
0 |
|
|
201437 |
79540986 |
1 |
O2N3C14H15 |
A2B3C14D15 |
-27.48 |
1.83 |
-9.74 |
-1.52 |
0 |
|
|
201438 |
79540987 |
1 |
NO2C17H21 |
AB2C17D21 |
-57.66 |
3.26 |
-9.4 |
0.1 |
0 |
|
|
201439 |
79540988 |
1 |
NSO2C13H17 |
ABC2D13E17 |
-79.03 |
5.33 |
-9.27 |
-0.49 |
0 |
|
|
201440 |
79540989 |
1 |
NO3C12H15 |
AB3C12D15 |
-101.37 |
4.6 |
-9.46 |
-0.34 |
0 |
|
|
201441 |
79540990 |
1 |
FNO2C15H18 |
ABC2D15E18 |
-129.28 |
4.87 |
-9.47 |
-0.43 |
0 |
|
|
201442 |
79540991 |
1 |
NO3C13H23 |
AB3C13D23 |
-160.44 |
3.59 |
-9.51 |
0.69 |
0 |
|
|
201443 |
79540992 |
1 |
BrFNO2C14H15 |
ABCD2E14F15 |
-106.95 |
5.19 |
-9.72 |
-0.96 |
0 |
|
|
201444 |
79540993 |
1 |
NO2C15H19 |
AB2C15D19 |
-81.62 |
4.2 |
-9.39 |
-0.05 |
0 |