List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
387669 |
134986398 |
2 |
NCl2C4H7 |
AB2C4D7 |
-64.87 |
2.81 |
-9.16 |
-0.78 |
0 |
|
|
387670 |
134986400 |
1 |
INC12H16 |
ABC12D16 |
45.0 |
3.75 |
-8.64 |
-0.53 |
0 |
|
|
387671 |
134986402 |
1 |
N2O2Cl3C9H15 |
A2B2C3D9E15 |
-80.3 |
6.96 |
-8.34 |
-1.33 |
0 |
|
|
387672 |
134986407 |
1 |
FNOC6H10 |
ABCD6E10 |
-82.16 |
3.24 |
-8.96 |
0.1 |
0 |
|
|
387673 |
134986410 |
1 |
NOC11H23 |
ABC11D23 |
-75.42 |
4.27 |
-8.68 |
0.86 |
0 |
|
|
387674 |
134986411 |
1 |
O2C11H16 |
A2B11C16 |
-36.95 |
1.35 |
-9.09 |
0.27 |
0 |
|
|
387675 |
134986412 |
1 |
OC16H20 |
AB16C20 |
-43.28 |
3.41 |
-9.62 |
-0.44 |
0 |
|
|
387676 |
134986413 |
1 |
OC16H18 |
AB16C18 |
-20.23 |
0.95 |
-8.74 |
0.24 |
0 |
|
|
387677 |
134986415 |
1 |
NSiO4C12H27 |
ABC4D12E27 |
-260.2 |
1.88 |
-8.74 |
0.48 |
0 |
|
|
387678 |
134986417 |
1 |
S2C13H24 |
A2B13C24 |
-14.98 |
0.7 |
-8.39 |
0.67 |
0 |
|
|
387679 |
134986423 |
1 |
O3C13H24 |
A3B13C24 |
-171.19 |
1.85 |
-9.4 |
1.62 |
0 |
|
|
387680 |
134986426 |
1 |
OSCl2C11H14 |
ABC2D11E14 |
-58.89 |
1.81 |
-8.89 |
-0.57 |
0 |
|
|
387681 |
134986427 |
1 |
O2C13H18 |
A2B13C18 |
-86.72 |
1.38 |
-8.73 |
0.39 |
0 |
|
|
387682 |
134986428 |
1 |
OCl2C12H16 |
AB2C12D16 |
-49.98 |
4.02 |
-10.12 |
-0.45 |
0 |
|
|
387683 |
134986430 |
1 |
F2O2C15H22 |
A2B2C15D22 |
-208.27 |
2.45 |
-9.1 |
0.04 |
0 |
|
|
387684 |
134986432 |
1 |
BrClH8C9 |
ABC8D9 |
36.92 |
1.89 |
-9.6 |
-0.6 |
0 |
|
|
387685 |
134986435 |
1 |
O3C16H24 |
A3B16C24 |
-116.88 |
3.24 |
-8.37 |
0.04 |
0 |
|
|
387686 |
134986441 |
1 |
ClN2H11C13 |
AB2C11D13 |
88.24 |
2.35 |
-8.38 |
-0.63 |
0 |
|
|
387687 |
134986442 |
1 |
Cl2N2F3C6H9 |
A2B2C3D6E9 |
-178.3 |
2.73 |
-9.94 |
-0.48 |
0 |
|
|
387688 |
134986443 |
1 |
ClN2F3C6H8 |
AB2C3D6E8 |
-147.82 |
2.32 |
-9.35 |
-0.79 |
0 |
|
|
387689 |
134986446 |
2 |
OC5H9 |
AB5C9 |
-88.64 |
1.53 |
-9.05 |
1.65 |
0 |
|
|
387690 |
134986449 |
1 |
BrSC10H17 |
ABC10D17 |
7.5 |
1.62 |
-8.7 |
-0.09 |
0 |
|
|
387691 |
134986450 |
1 |
BrF3O3H6C7 |
AB3C3D6E7 |
-248.26 |
2.95 |
-11.27 |
-1.72 |
0 |
|
|
387692 |
134986453 |
1 |
O2Cl3C7H11 |
A2B3C7D11 |
-126.02 |
3.61 |
-10.35 |
-0.28 |
0 |
|
|
387693 |
134986454 |
2 |
SeC4H9 |
AB4C9 |
-23.45 |
0.79 |
-8.11 |
0.14 |
0 |
|
|
387694 |
134986455 |
1 |
O4C9H12 |
A4B9C12 |
-115.36 |
4.25 |
-8.83 |
-0.95 |
0 |
|
|
387695 |
134986456 |
1 |
S2C17H28 |
A2B17C28 |
-28.61 |
3.48 |
-8.43 |
0.01 |
0 |
|
|
387696 |
134986459 |
2 |
SC5H7 |
AB5C7 |
16.16 |
2.43 |
-8.65 |
0.01 |
0 |
|
|
387697 |
134986463 |
1 |
NOS2C15H25 |
ABC2D15E25 |
-61.68 |
3.82 |
-8.48 |
-0.16 |
0 |
|
|
387698 |
134986466 |
1 |
NO4C13H15 |
AB4C13D15 |
-114.25 |
3.18 |
-9.3 |
-0.7 |
0 |
|
|
387699 |
134986470 |
1 |
MnO5C12H13 |
AB5C12D13 |
82.6 |
2.48 |
-5.86 |
-4.19 |
0 |
|
|
387700 |
134986474 |
1 |
ClHgO2C10H17 |
ABC2D10E17 |
-79.83 |
4.91 |
-9.04 |
0.14 |
0 |
|
|
387701 |
134986479 |
1 |
NO2C10H15 |
AB2C10D15 |
-71.28 |
6.04 |
-8.07 |
0.16 |
0 |
|
|
387702 |
134986492 |
1 |
ClSO3C10H17 |
ABC3D10E17 |
-165.54 |
2.61 |
-8.95 |
-0.28 |
0 |
|
|
387703 |
134986502 |
1 |
NO3C12H17 |
AB3C12D17 |
-117.75 |
5.64 |
-10.34 |
0.17 |
0 |
|
|
387704 |
134986509 |
1 |
NOS2C9H11 |
ABC2D9E11 |
3.7 |
3.38 |
-8.63 |
-0.99 |
0 |
|
|
387705 |
134986510 |
1 |
NOS2C14H15 |
ABC2D14E15 |
15.26 |
2.39 |
-8.5 |
-0.37 |
0 |
|
|
387706 |
134986513 |
1 |
OF2H4N4C9 |
AB2C4D4E9 |
36.1 |
2.47 |
-10.69 |
-3.0 |
0 |
|
|
387707 |
134986517 |
1 |
BrClNSO2C11H15 |
ABCDE2F11G15 |
-48.77 |
3.15 |
-9.36 |
-0.98 |
0 |
|
|
387708 |
134986538 |
2 |
OC8H8 |
AB8C8 |
-35.06 |
3.78 |
-9.03 |
-0.53 |
0 |
|
|
387709 |
134986541 |
1 |
ClIO2C5H10 |
ABC2D5E10 |
-93.26 |
1.28 |
-9.96 |
-1.06 |
0 |
|
|
387710 |
134986542 |
2 |
O2C4H7 |
A2B4C7 |
-177.66 |
1.74 |
-9.83 |
1.41 |
0 |
|
|
387711 |
134986543 |
1 |
OS2C9H10 |
AB2C9D10 |
1.8 |
3.44 |
-8.62 |
-0.1 |
0 |
|
|
387713 |
134986554 |
1 |
ClNOH12C13 |
ABCD12E13 |
-11.85 |
2.23 |
-8.14 |
-0.36 |
0 |
|
|
387714 |
134986556 |
1 |
SO4C13H24 |
AB4C13D24 |
-211.89 |
1.68 |
-9.08 |
-0.28 |
0 |
|
|
387715 |
134986557 |
1 |
ClFN4H6C10 |
ABC4D6E10 |
84.26 |
3.03 |
-10.44 |
-2.81 |
0 |
|
|
387716 |
134986558 |
1 |
NSiO2C12H19 |
ABC2D12E19 |
-105.18 |
5.93 |
-8.09 |
0.06 |
0 |
|
|
387717 |
134986560 |
1 |
NO2C14H25 |
AB2C14D25 |
-117.67 |
4.29 |
-8.85 |
0.49 |
0 |
|
|
387718 |
134986563 |
1 |
ClNO2C8H14 |
ABC2D8E14 |
-31.26 |
5.29 |
-10.52 |
-1.31 |
0 |
|
|
387719 |
134986566 |
1 |
CrNF2H3O6C9 |
ABC2D3E6F9 |
-245.81 |
2.38 |
-9.1 |
-0.67 |
0 |
|
|
387720 |
134986567 |
1 |
NOF2H3C4 |
ABC2D3E4 |
-62.47 |
4.02 |
-9.49 |
-0.23 |
0 |
|
|
387721 |
134986586 |
1 |
SeO3C11H14 |
AB3C11D14 |
-103.05 |
1.34 |
-8.83 |
-0.57 |
0 |
|
|
387723 |
134986589 |
1 |
NSiO2C13H25 |
ABC2D13E25 |
-114.94 |
4.76 |
-9.79 |
0.9 |
0 |
|
|
387724 |
134986593 |
1 |
ClNO3C9H18 |
ABC3D9E18 |
-170.26 |
6.12 |
-8.74 |
0.36 |
0 |
|
|
387725 |
134986599 |
1 |
PSO3C12H23 |
ABC3D12E23 |
-182.2 |
2.3 |
-8.38 |
0.23 |
0 |
|
|
387726 |
134986605 |
2 |
OSC6H11 |
ABC6D11 |
-82.31 |
4.82 |
-8.82 |
-0.6 |
0 |
|
|
387727 |
134986614 |
1 |
NPSiC6H16 |
ABCD6E16 |
-121.41 |
6.63 |
-8.2 |
0.9 |
0 |
|
|
387728 |
134986615 |
1 |
ClMgPC8H16 |
ABCD8E16 |
-15.39 |
3.66 |
-7.52 |
-0.44 |
0 |
|
|
387729 |
134986618 |
2 |
Cl2S2C5H6 |
A2B2C5D6 |
25.7 |
4.42 |
-8.5 |
-1.75 |
0 |
|
|
387730 |
134986620 |
2 |
NSC4H4 |
ABC4D4 |
97.18 |
2.4 |
-9.24 |
-0.74 |
0 |
|
|
387731 |
134986624 |
1 |
O4C11H20 |
A4B11C20 |
-208.89 |
1.38 |
-10.16 |
0.86 |
0 |
|
|
387732 |
134986631 |
1 |
N4C15H18 |
A4B15C18 |
103.28 |
6.1 |
-10.48 |
-2.05 |
0 |
|
|
387733 |
134986638 |
1 |
N2O3C11H14 |
A2B3C11D14 |
-14.5 |
9.95 |
-8.91 |
-1.04 |
0 |
|
|
387734 |
134986639 |
1 |
NO3C13H15 |
AB3C13D15 |
-87.72 |
4.8 |
-9.91 |
-0.17 |
0 |
|
|
387735 |
134986642 |
1 |
NO3C9H15 |
AB3C9D15 |
-134.62 |
2.99 |
-9.95 |
-0.46 |
0 |
|
|
387736 |
134986645 |
1 |
IF2O2C13H21 |
AB2C2D13E21 |
-210.24 |
3.48 |
-9.96 |
-1.17 |
0 |
|
|
387737 |
134986646 |
1 |
NO3C12H17 |
AB3C12D17 |
-119.63 |
3.06 |
-10.55 |
-0.11 |
0 |
|
|
387738 |
134986648 |
2 |
OC4H8 |
AB4C8 |
-121.16 |
2.54 |
-9.83 |
1.94 |
0 |
|
|
387739 |
134986649 |
1 |
SO4C6H10 |
AB4C6D10 |
-177.65 |
4.12 |
-8.94 |
0.05 |
0 |
|
|
387740 |
134986650 |
1 |
OC7H14 |
AB7C14 |
-45.31 |
1.62 |
-9.47 |
2.2 |
0 |
|
|
387741 |
134986680 |
1 |
F3O3C12H13 |
A3B3C12D13 |
-276.05 |
4.09 |
-9.49 |
-1.04 |
0 |
|
|
387742 |
134986681 |
1 |
NO3C10H13 |
AB3C10D13 |
-28.44 |
2.92 |
-9.27 |
-0.78 |
0 |
|
|
387743 |
134986682 |
1 |
N2Cl3C7H11 |
A2B3C7D11 |
-11.52 |
1.37 |
-9.31 |
-0.58 |
0 |
|
|
387744 |
134986689 |
2 |
OSC5H9 |
ABC5D9 |
-108.76 |
2.84 |
-8.95 |
-0.04 |
0 |
|
|
387745 |
134986691 |
1 |
ClO5C12H19 |
AB5C12D19 |
-220.78 |
1.64 |
-9.86 |
0.46 |
0 |