List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
203445 |
79831470 |
1 |
BrFNSH13C17 |
ABCDE13F17 |
18.29 |
1.67 |
-8.86 |
-0.8 |
0 |
|
|
203446 |
79831471 |
1 |
N3O5C10H13 |
A3B5C10D13 |
-110.16 |
2.2 |
-9.95 |
-1.12 |
0 |
|
|
203447 |
79831472 |
1 |
O2N4C9H14 |
A2B4C9D14 |
-15.14 |
3.62 |
-10.01 |
-0.21 |
0 |
|
|
203448 |
79831473 |
1 |
ClN2O4C12H13 |
AB2C4D12E13 |
-59.25 |
5.56 |
-10.0 |
-1.54 |
0 |
|
|
203449 |
79831550 |
1 |
ClN3O3C14H16 |
AB3C3D14E16 |
-23.56 |
5.35 |
-8.79 |
-1.56 |
0 |
|
|
203450 |
79831666 |
1 |
ClN2O3C14H15 |
AB2C3D14E15 |
-26.56 |
6.43 |
-9.75 |
-1.51 |
0 |
|
|
203451 |
79831859 |
1 |
ClSN3O3H8C11 |
ABC3D3E8F11 |
12.42 |
4.79 |
-9.09 |
-1.81 |
0 |
|
|
203452 |
79832178 |
1 |
BrSN2C14H15 |
ABC2D14E15 |
50.35 |
1.82 |
-9.09 |
-1.04 |
0 |
|
|
203453 |
79832526 |
1 |
BrSN2C13H13 |
ABC2D13E13 |
55.05 |
1.49 |
-9.07 |
-1.08 |
0 |
|
|
203454 |
79832594 |
1 |
NF2O2C12H17 |
AB2C2D12E17 |
-163.6 |
3.65 |
-9.11 |
-0.24 |
0 |
|
|
203455 |
79832623 |
1 |
BrFNSH11C16 |
ABCDE11F16 |
33.74 |
0.45 |
-9.23 |
-0.74 |
0 |
|
|
203456 |
79832654 |
1 |
BrNSH14C17 |
ABCD14E17 |
63.53 |
1.64 |
-8.66 |
-1.03 |
0 |
|
|
203457 |
79832752 |
1 |
NF2O3H11C15 |
AB2C3D11E15 |
-141.84 |
3.44 |
-9.08 |
-1.46 |
0 |
|
|
203458 |
79833133 |
1 |
SO3N4C12H16 |
AB3C4D12E16 |
-69.96 |
6.53 |
-8.94 |
-0.61 |
0 |
|
|
203459 |
79833193 |
1 |
ClNSO2C16H24 |
ABCD2E16F24 |
-96.43 |
5.31 |
-8.92 |
-0.53 |
0 |
|
|
203460 |
79833212 |
2 |
NOC6H9 |
ABC6D9 |
-61.52 |
3.43 |
-8.93 |
0.0 |
0 |
|
|
203461 |
79833378 |
2 |
NOC6H9 |
ABC6D9 |
-62.7 |
4.07 |
-8.92 |
-0.2 |
0 |
|
|
203462 |
79833754 |
1 |
N2O3C14H18 |
A2B3C14D18 |
-109.14 |
5.59 |
-9.57 |
-0.57 |
0 |
|
|
203463 |
79834180 |
1 |
NSO2C13H27 |
ABC2D13E27 |
-132.14 |
5.9 |
-9.15 |
0.86 |
0 |
|
|
203464 |
79835170 |
1 |
NOSC15H17 |
ABCD15E17 |
-8.67 |
11.49 |
-8.02 |
-1.03 |
0 |
|
|
203465 |
79835554 |
1 |
N3O3C15H23 |
A3B3C15D23 |
-100.34 |
5.74 |
-9.59 |
0.37 |
0 |
|
|
203466 |
79835595 |
1 |
N2O3C16H18 |
A2B3C16D18 |
-94.39 |
1.71 |
-8.8 |
-0.5 |
0 |
|
|
203467 |
79835702 |
1 |
SN2C18H24 |
AB2C18D24 |
25.34 |
2.02 |
-8.78 |
-0.59 |
0 |
|
|
203468 |
79835729 |
1 |
N2C13H20 |
A2B13C20 |
3.48 |
2.81 |
-9.48 |
0.05 |
0 |
|
|
203469 |
79835769 |
1 |
BrNO3C16H18 |
ABC3D16E18 |
-95.48 |
2.49 |
-9.57 |
-0.79 |
0 |
|
|
203470 |
79836067 |
1 |
NO2C14H29 |
AB2C14D29 |
-127.48 |
3.11 |
-8.59 |
2.2 |
0 |
|
|
203471 |
79836178 |
1 |
N2C19H28 |
A2B19C28 |
4.17 |
4.02 |
-8.19 |
0.28 |
0 |
|
|
203472 |
79836179 |
1 |
N2C19H38 |
A2B19C38 |
-61.87 |
1.53 |
-8.02 |
3.14 |
0 |
|
|
203473 |
79836192 |
1 |
FN2C18H29 |
AB2C18D29 |
-49.92 |
2.02 |
-8.47 |
0.12 |
0 |
|
|
203474 |
79836258 |
2 |
NC9H18 |
AB9C18 |
-51.17 |
2.09 |
-8.16 |
2.98 |
0 |
|
|
203475 |
79836259 |
1 |
O2F3C10H13 |
A2B3C10D13 |
-252.0 |
6.22 |
-10.31 |
-0.68 |
0 |
|
|
203476 |
79836260 |
2 |
OC7H12 |
AB7C12 |
-127.69 |
1.2 |
-9.8 |
0.23 |
0 |
|
|
203477 |
79836261 |
1 |
NC14H29 |
AB14C29 |
-58.36 |
1.34 |
-8.47 |
3.18 |
0 |
|
|
203478 |
79836567 |
1 |
SN2O2C16H26 |
AB2C2D16E26 |
-99.69 |
5.29 |
-8.49 |
-0.07 |
0 |
|
|
203479 |
79836589 |
2 |
NC8H15 |
AB8C15 |
-20.7 |
2.84 |
-8.46 |
2.73 |
0 |
|
|
203480 |
79836590 |
1 |
NO2C14H29 |
AB2C14D29 |
-128.99 |
1.61 |
-8.83 |
1.72 |
0 |
|
|
203481 |
79836681 |
1 |
SN2O2C16H26 |
AB2C2D16E26 |
-99.2 |
3.72 |
-7.78 |
0.25 |
0 |
|
|
203482 |
79836682 |
1 |
SN2O2C16H18 |
AB2C2D16E18 |
-48.49 |
4.48 |
-8.55 |
-0.11 |
0 |
|
|
203483 |
79836963 |
1 |
NOC15H29 |
ABC15D29 |
-96.67 |
2.07 |
-9.06 |
2.48 |
0 |
|
|
203484 |
79837130 |
1 |
F2N2O3C11H12 |
A2B2C3D11E12 |
-189.52 |
6.85 |
-9.52 |
-1.1 |
0 |
|
|
203485 |
79837131 |
1 |
NF2O4C11H11 |
AB2C4D11E11 |
-237.25 |
7.54 |
-9.5 |
-1.2 |
0 |
|
|
203486 |
79837132 |
1 |
F2N2O3C11H12 |
A2B2C3D11E12 |
-201.07 |
3.08 |
-9.4 |
-1.02 |
0 |
|
|
203487 |
79837133 |
1 |
NF2O3C12H13 |
AB2C3D12E13 |
-202.8 |
6.83 |
-9.32 |
-0.91 |
0 |
|
|
203488 |
79837134 |
1 |
NF2O2C15H19 |
AB2C2D15E19 |
-178.38 |
8.87 |
-9.05 |
-0.72 |
0 |
|
|
203489 |
79837245 |
1 |
OC13H20 |
AB13C20 |
-58.73 |
2.22 |
-9.04 |
0.5 |
0 |
|
|
203490 |
79837496 |
1 |
BrO2C13H17 |
AB2C13D17 |
-75.29 |
3.88 |
-8.28 |
-0.34 |
0 |
|
|
203491 |
79837657 |
1 |
BrNC11H14 |
ABC11D14 |
5.22 |
4.21 |
-9.31 |
-0.01 |
0 |
|
|
203492 |
79837834 |
1 |
ClNO2C14H18 |
ABC2D14E18 |
-80.0 |
1.97 |
-8.55 |
-0.07 |
0 |
|
|
203493 |
79837835 |
1 |
BrNOC13H18 |
ABCD13E18 |
-43.65 |
4.1 |
-8.88 |
-0.06 |
0 |
|
|
203494 |
79837836 |
1 |
BrNOC15H22 |
ABCD15E22 |
-48.0 |
2.97 |
-8.58 |
0.02 |
0 |