List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
201545 |
79553484 |
1 |
NSO3C15H27 |
ABC3D15E27 |
-165.65 |
3.81 |
-9.53 |
0.41 |
0 |
|
|
201546 |
79553700 |
1 |
SN3C13H13 |
AB3C13D13 |
90.32 |
3.54 |
-9.6 |
-0.97 |
0 |
|
|
201547 |
79554379 |
1 |
SO2N3C13H15 |
AB2C3D13E15 |
-31.39 |
4.64 |
-9.37 |
-1.35 |
0 |
|
|
201548 |
79554410 |
1 |
NO2C17H25 |
AB2C17D25 |
-68.73 |
4.68 |
-8.4 |
0.17 |
0 |
|
|
201549 |
79555143 |
1 |
SN2F3O3H9C10 |
AB2C3D3E9F10 |
-253.19 |
3.17 |
-9.76 |
-1.57 |
0 |
|
|
201550 |
79555442 |
1 |
N2S2O5C11H20 |
A2B2C5D11E20 |
-178.62 |
6.54 |
-9.57 |
-0.42 |
0 |
|
|
201551 |
79555443 |
1 |
ClON2C6H7 |
ABC2D6E7 |
30.34 |
2.55 |
-9.37 |
-0.22 |
0 |
|
|
201552 |
79555689 |
1 |
ClO2N5C13H16 |
AB2C5D13E16 |
61.43 |
3.83 |
-9.04 |
-1.98 |
0 |
|
|
201553 |
79555875 |
1 |
ClSO2N3C14H18 |
ABC2D3E14F18 |
-34.38 |
4.74 |
-9.26 |
-0.62 |
0 |
|
|
201554 |
79556260 |
1 |
ClOH2N2F5C9 |
ABC2D2E5F9 |
-173.61 |
2.77 |
-9.64 |
-1.91 |
0 |
|
|
201555 |
79556261 |
1 |
BrON2C11H11 |
ABC2D11E11 |
29.45 |
2.96 |
-9.13 |
-0.62 |
0 |
|
|
201556 |
79556262 |
1 |
BrON2C8H13 |
ABC2D8E13 |
-3.62 |
2.61 |
-9.37 |
-0.27 |
0 |
|
|
201557 |
79556263 |
1 |
BrON3H8C12 |
ABC3D8E12 |
80.79 |
4.39 |
-9.23 |
-1.21 |
0 |
|
|
201558 |
79556264 |
1 |
BrON2C11H11 |
ABC2D11E11 |
31.7 |
3.96 |
-9.15 |
-0.69 |
0 |
|
|
201559 |
79556265 |
1 |
BrN3O3H8C10 |
AB3C3D8E10 |
35.59 |
3.45 |
-9.66 |
-1.54 |
0 |
|
|
201560 |
79556512 |
1 |
ClN2O2C16H17 |
AB2C2D16E17 |
16.81 |
3.48 |
-9.59 |
-1.35 |
0 |
|
|
201561 |
79556833 |
1 |
ClN4C11H17 |
AB4C11D17 |
18.45 |
2.66 |
-8.89 |
-0.42 |
0 |
|
|
201562 |
79556834 |
1 |
ClO2N3C15H18 |
AB2C3D15E18 |
19.5 |
6.32 |
-8.88 |
-1.86 |
0 |
|
|
201563 |
79556835 |
1 |
ClO2N3C15H18 |
AB2C3D15E18 |
18.27 |
3.3 |
-8.98 |
-1.89 |
0 |
|
|
201564 |
79556836 |
1 |
ClO2N3C15H16 |
AB2C3D15E16 |
51.02 |
6.33 |
-8.89 |
-1.91 |
0 |
|
|
201565 |
79557291 |
1 |
FION2H8C10 |
ABCD2E8F10 |
8.89 |
2.84 |
-9.38 |
-1.24 |
0 |
|
|
201566 |
79557292 |
1 |
BrIN2O2H8C10 |
ABC2D2E8F10 |
27.85 |
3.38 |
-9.11 |
-1.17 |
0 |
|
|
201567 |
79557293 |
1 |
NSO2C17H31 |
ABC2D17E31 |
-133.76 |
5.24 |
-8.63 |
0.61 |
0 |
|
|
201568 |
79557294 |
1 |
NSO2C17H29 |
ABC2D17E29 |
-106.25 |
5.98 |
-8.59 |
0.7 |
0 |
|
|
201569 |
79557295 |
1 |
NSO2C17H31 |
ABC2D17E31 |
-129.89 |
2.4 |
-8.56 |
0.78 |
0 |
|
|
201570 |
79557569 |
1 |
O2N3C16H25 |
A2B3C16D25 |
-67.7 |
1.99 |
-7.74 |
0.24 |
0 |
|
|
201571 |
79557570 |
1 |
O2N3C16H19 |
A2B3C16D19 |
-29.36 |
5.53 |
-7.87 |
-0.58 |
0 |
|
|
201572 |
79557571 |
1 |
ClN3C11H18 |
AB3C11D18 |
0.69 |
3.43 |
-8.75 |
-0.26 |
0 |
|
|
201573 |
79558030 |
1 |
NO2C15H25 |
AB2C15D25 |
-105.0 |
3.47 |
-8.87 |
0.55 |
0 |
|
|
201574 |
79558031 |
1 |
FO2C17H21 |
AB2C17D21 |
-130.01 |
4.1 |
-9.87 |
-0.22 |
0 |
|
|
201575 |
79558032 |
1 |
NO2C14H23 |
AB2C14D23 |
-101.99 |
5.23 |
-9.31 |
0.73 |
0 |
|
|
201576 |
79558033 |
1 |
NO2C14H23 |
AB2C14D23 |
-107.38 |
4.68 |
-9.41 |
0.59 |
0 |
|
|
201577 |
79558293 |
1 |
N2C15H28 |
A2B15C28 |
-20.0 |
0.85 |
-8.53 |
2.79 |
0 |
|
|
201578 |
79558619 |
1 |
NSO6C9H17 |
ABC6D9E17 |
-269.05 |
3.09 |
-10.5 |
-0.12 |
0 |
|
|
201579 |
79558886 |
1 |
N3C16H25 |
A3B16C25 |
26.24 |
2.07 |
-9.19 |
-0.52 |
0 |
|
|
201580 |
79559400 |
1 |
NOC12H21 |
ABC12D21 |
-63.98 |
3.4 |
-9.18 |
2.6 |
0 |
|
|
201581 |
79559415 |
1 |
NOSC14H19 |
ABCD14E19 |
-26.89 |
2.75 |
-9.24 |
-0.41 |
0 |
|
|
201582 |
79559416 |
1 |
BrOC16H19 |
ABC16D19 |
-29.1 |
2.35 |
-9.65 |
-0.36 |
0 |
|
|
201583 |
79559417 |
1 |
NOC15H19 |
ABC15D19 |
-29.12 |
1.65 |
-8.54 |
-0.31 |
0 |
|
|
201584 |
79559418 |
1 |
ClNOC15H18 |
ABCD15E18 |
-39.77 |
0.57 |
-8.89 |
-0.64 |
0 |
|
|
201585 |
79559462 |
2 |
NC9H16 |
AB9C16 |
-3.74 |
1.19 |
-8.0 |
2.51 |
0 |
|
|
201586 |
79559724 |
1 |
N3C16H27 |
A3B16C27 |
-5.08 |
2.55 |
-8.77 |
0.07 |
0 |
|
|
201587 |
79559910 |
1 |
NOC16H25 |
ABC16D25 |
-64.56 |
2.26 |
-8.87 |
0.47 |
0 |
|
|
201588 |
79560121 |
1 |
FN2C16H25 |
AB2C16D25 |
-60.53 |
2.78 |
-8.2 |
0.22 |
0 |
|
|
201589 |
79560133 |
1 |
O2N3C12H19 |
A2B3C12D19 |
-27.29 |
4.79 |
-8.85 |
-0.5 |
0 |
|
|
201590 |
79560180 |
1 |
O3C17H22 |
A3B17C22 |
-120.98 |
1.98 |
-9.93 |
-0.45 |
0 |
|
|
201591 |
79560580 |
1 |
NO3C15H29 |
AB3C15D29 |
-199.33 |
1.89 |
-9.34 |
1.05 |
0 |
|
|
201592 |
79561127 |
1 |
FNC19H28 |
ABC19D28 |
-49.93 |
1.08 |
-8.87 |
-0.04 |
0 |
|
|
201593 |
79561204 |
1 |
NC20H37 |
AB20C37 |
-58.74 |
1.63 |
-8.69 |
3.14 |
0 |
|
|
201594 |
79561469 |
1 |
SO2N6C9H14 |
AB2C6D9E14 |
21.39 |
6.17 |
-9.41 |
-1.44 |
0 |