List Systems
Back
Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
292700 |
117357242 |
2 |
ON2H5C6 |
AB2C5D6 |
25.76 |
6.12 |
-8.49 |
-0.48 |
0 |
|
|
292701 |
117357248 |
2 |
ON2H5C6 |
AB2C5D6 |
27.81 |
3.13 |
-8.81 |
-0.93 |
0 |
|
|
292702 |
117357249 |
2 |
ON2H5C6 |
AB2C5D6 |
28.57 |
5.49 |
-8.88 |
-0.88 |
0 |
|
|
292703 |
117357251 |
2 |
ON2H5C6 |
AB2C5D6 |
52.14 |
6.13 |
-9.1 |
-1.71 |
0 |
|
|
292704 |
117357255 |
1 |
OSF2N2H8C10 |
ABC2D2E8F10 |
-42.85 |
2.55 |
-8.71 |
-1.22 |
0 |
|
|
292705 |
117357264 |
1 |
OSF2N2H8C10 |
ABC2D2E8F10 |
-49.03 |
3.56 |
-8.96 |
-0.8 |
0 |
|
|
292706 |
117357271 |
1 |
OSF2N2H8C10 |
ABC2D2E8F10 |
-46.76 |
4.24 |
-8.95 |
-0.99 |
0 |
|
|
292707 |
117357299 |
1 |
FO4C12H15 |
AB4C12D15 |
-203.17 |
5.62 |
-9.61 |
-0.63 |
0 |
|
|
292708 |
117357304 |
1 |
FO4C12H15 |
AB4C12D15 |
-208.11 |
4.16 |
-9.09 |
-0.21 |
0 |
|
|
292709 |
117357325 |
1 |
FO4C12H15 |
AB4C12D15 |
-201.03 |
6.94 |
-9.07 |
-0.48 |
0 |
|
|
292710 |
117357326 |
1 |
FO4C12H15 |
AB4C12D15 |
-207.39 |
7.56 |
-9.09 |
-0.27 |
0 |
|
|
292711 |
117357331 |
1 |
FO4C12H15 |
AB4C12D15 |
-207.76 |
3.96 |
-8.82 |
-0.56 |
0 |
|
|
292712 |
117357336 |
1 |
FO4C12H15 |
AB4C12D15 |
-206.41 |
4.94 |
-9.4 |
-0.52 |
0 |
|
|
292713 |
117357344 |
1 |
FO4C12H15 |
AB4C12D15 |
-205.84 |
2.26 |
-8.77 |
-0.42 |
0 |
|
|
292714 |
117357352 |
1 |
FO4C12H15 |
AB4C12D15 |
-210.86 |
5.65 |
-9.14 |
-0.45 |
0 |
|
|
292715 |
117357366 |
1 |
FO4C12H15 |
AB4C12D15 |
-207.78 |
5.9 |
-9.44 |
-0.65 |
0 |
|
|
292716 |
117357387 |
1 |
FO4C12H15 |
AB4C12D15 |
-204.87 |
2.59 |
-9.88 |
-0.4 |
0 |
|
|
292717 |
117357410 |
1 |
FO4C12H15 |
AB4C12D15 |
-208.14 |
3.99 |
-9.89 |
-0.53 |
0 |
|
|
292718 |
117357422 |
1 |
FO4C12H15 |
AB4C12D15 |
-207.33 |
4.0 |
-9.22 |
-0.46 |
0 |
|
|
292719 |
117357423 |
1 |
FO4C12H15 |
AB4C12D15 |
-202.62 |
1.85 |
-9.09 |
-0.46 |
0 |
|
|
292720 |
117357425 |
1 |
FO4C12H15 |
AB4C12D15 |
-212.67 |
4.66 |
-9.53 |
-0.57 |
0 |
|
|
292721 |
117357441 |
1 |
FO4C12H15 |
AB4C12D15 |
-182.09 |
3.98 |
-8.38 |
-0.23 |
0 |
|
|
292722 |
117357450 |
1 |
FO4C12H15 |
AB4C12D15 |
-174.32 |
5.46 |
-8.63 |
-0.39 |
0 |
|
|
292723 |
117357455 |
1 |
FO4C12H15 |
AB4C12D15 |
-197.55 |
6.38 |
-9.13 |
-0.24 |
0 |
|
|
292724 |
117357461 |
1 |
FO4C12H15 |
AB4C12D15 |
-202.43 |
4.4 |
-9.34 |
-0.44 |
0 |
|
|
292725 |
117357465 |
1 |
FO4C12H15 |
AB4C12D15 |
-197.87 |
4.83 |
-8.56 |
-0.1 |
0 |
|
|
292726 |
117357469 |
1 |
FO4C12H15 |
AB4C12D15 |
-203.68 |
2.75 |
-8.88 |
-0.03 |
0 |
|
|
292727 |
117357470 |
1 |
FO4C12H15 |
AB4C12D15 |
-201.3 |
4.19 |
-9.14 |
-0.26 |
0 |
|
|
292728 |
117357481 |
1 |
FO4C12H15 |
AB4C12D15 |
-215.35 |
2.78 |
-9.28 |
-0.89 |
0 |
|
|
292729 |
117357498 |
1 |
SO5C10H10 |
AB5C10D10 |
-185.72 |
4.54 |
-10.43 |
-1.06 |
0 |
|
|
292730 |
117357500 |
1 |
FN2O3C11H15 |
AB2C3D11E15 |
-86.38 |
7.8 |
-9.5 |
-1.25 |
0 |
|
|
292731 |
117357501 |
1 |
SO5C10H10 |
AB5C10D10 |
-166.15 |
4.84 |
-9.48 |
-0.97 |
0 |
|
|
292732 |
117357504 |
1 |
SO5C10H10 |
AB5C10D10 |
-178.14 |
2.88 |
-10.51 |
-1.82 |
0 |
|
|
292733 |
117357512 |
1 |
FSO3C11H11 |
ABC3D11E11 |
-141.46 |
5.74 |
-9.21 |
-0.81 |
0 |
|
|
292734 |
117357514 |
1 |
FSO3C11H11 |
ABC3D11E11 |
-139.48 |
2.49 |
-8.76 |
-1.34 |
0 |
|
|
292735 |
117357524 |
1 |
F2O2C13H16 |
A2B2C13D16 |
-188.59 |
4.17 |
-9.82 |
-0.24 |
0 |
|
|
292736 |
117357525 |
1 |
F2O2C13H16 |
A2B2C13D16 |
-194.69 |
2.55 |
-9.65 |
-0.18 |
0 |
|
|
292737 |
117357528 |
1 |
F2O2C13H16 |
A2B2C13D16 |
-202.4 |
5.2 |
-9.59 |
-0.07 |
0 |
|
|
292738 |
117357550 |
1 |
F2O2C13H16 |
A2B2C13D16 |
-167.36 |
5.07 |
-9.17 |
-0.16 |
0 |
|
|
292739 |
117357557 |
1 |
F2O2C13H16 |
A2B2C13D16 |
-185.86 |
4.48 |
-9.82 |
-0.42 |
0 |
|
|
292740 |
117357560 |
1 |
F2O2C13H16 |
A2B2C13D16 |
-186.98 |
2.89 |
-10.02 |
-0.54 |
0 |
|
|
292741 |
117357569 |
1 |
F2O2C13H16 |
A2B2C13D16 |
-186.12 |
3.93 |
-9.52 |
-0.37 |
0 |
|
|
292742 |
117357571 |
1 |
F2O2C13H16 |
A2B2C13D16 |
-196.08 |
5.31 |
-9.61 |
-0.08 |
0 |
|
|
292743 |
117357663 |
2 |
NOC7H7 |
ABC7D7 |
-28.27 |
5.37 |
-9.48 |
-0.72 |
0 |
|
|
292744 |
117357667 |
2 |
NOC7H7 |
ABC7D7 |
-47.33 |
5.79 |
-8.88 |
-0.45 |
0 |
|
|
292745 |
117357752 |
1 |
ON4C13H14 |
AB4C13D14 |
44.12 |
5.33 |
-7.86 |
0.11 |
0 |
|
|
292746 |
117357801 |
1 |
ON4C13H14 |
AB4C13D14 |
23.99 |
5.08 |
-8.51 |
-0.21 |
0 |
|
|
292747 |
117357945 |
1 |
SO4C11H14 |
AB4C11D14 |
-157.54 |
7.73 |
-8.76 |
-0.49 |
0 |
|
|
292748 |
117357968 |
1 |
SO4C11H14 |
AB4C11D14 |
-163.83 |
6.85 |
-10.33 |
-0.83 |
0 |
|
|
292749 |
117357978 |
1 |
FSO2C12H15 |
ABC2D12E15 |
-133.1 |
2.84 |
-8.74 |
-0.56 |
0 |
|
|
292750 |
117358016 |
1 |
ON2C15H18 |
AB2C15D18 |
4.91 |
2.67 |
-9.22 |
-0.69 |
0 |
|
|
292751 |
117358044 |
1 |
ON2C15H18 |
AB2C15D18 |
2.7 |
2.62 |
-8.96 |
-0.67 |
0 |
|
|
292752 |
117358123 |
1 |
ON2C15H18 |
AB2C15D18 |
14.6 |
2.03 |
-8.94 |
-0.54 |
0 |
|
|
292753 |
117358152 |
2 |
N2C7H9 |
A2B7C9 |
87.07 |
1.96 |
-9.07 |
-0.55 |
0 |
|
|
292754 |
117358153 |
2 |
N2C7H9 |
A2B7C9 |
89.99 |
1.86 |
-9.42 |
-0.34 |
0 |
|
|
292755 |
117358157 |
2 |
N2C7H9 |
A2B7C9 |
64.19 |
4.55 |
-9.37 |
-0.8 |
0 |
|
|
292756 |
117358163 |
2 |
N2C7H9 |
A2B7C9 |
71.44 |
5.5 |
-9.39 |
-0.82 |
0 |
|
|
292757 |
117358173 |
2 |
N2C7H9 |
A2B7C9 |
54.97 |
3.48 |
-8.1 |
0.17 |
0 |
|
|
292758 |
117358234 |
2 |
N2C7H9 |
A2B7C9 |
62.44 |
4.5 |
-9.13 |
-0.73 |
0 |
|
|
292759 |
117358245 |
2 |
N2C7H9 |
A2B7C9 |
69.79 |
3.05 |
-9.06 |
-0.53 |
0 |
|
|
292760 |
117358254 |
2 |
N2C7H9 |
A2B7C9 |
77.38 |
4.35 |
-8.51 |
0.16 |
0 |
|
|
292761 |
117358271 |
1 |
SO3C12H18 |
AB3C12D18 |
-135.37 |
6.5 |
-9.76 |
-0.46 |
0 |
|
|
292762 |
117358324 |
1 |
SN2O2C11H18 |
AB2C2D11E18 |
-77.14 |
4.23 |
-8.85 |
0.11 |
0 |
|
|
292763 |
117358366 |
2 |
NC8H11 |
AB8C11 |
5.49 |
4.03 |
-8.07 |
0.26 |
0 |
|
|
292764 |
117358369 |
2 |
NC8H11 |
AB8C11 |
13.44 |
3.81 |
-7.99 |
0.2 |
0 |
|
|
292765 |
117358372 |
2 |
NC8H11 |
AB8C11 |
7.49 |
2.88 |
-8.04 |
0.32 |
0 |
|
|
292766 |
117358424 |
1 |
ClFN2O2H8C10 |
ABC2D2E8F10 |
-58.48 |
3.41 |
-9.29 |
-0.75 |
0 |
|
|
292767 |
117358436 |
1 |
ClFN2O2H8C10 |
ABC2D2E8F10 |
-44.38 |
4.77 |
-8.98 |
-0.76 |
0 |
|
|
292768 |
117358455 |
1 |
ClFN2O2H8C10 |
ABC2D2E8F10 |
-50.83 |
3.05 |
-8.72 |
-0.66 |
0 |
|
|
292769 |
117358456 |
1 |
ClFN2O2H8C10 |
ABC2D2E8F10 |
-46.2 |
3.71 |
-8.79 |
-0.66 |
0 |
|
|
292770 |
117358466 |
1 |
ClFN2O2H8C10 |
ABC2D2E8F10 |
-47.68 |
5.31 |
-9.11 |
-1.0 |
0 |
|
|
292771 |
117358467 |
1 |
ClFN2O2H8C10 |
ABC2D2E8F10 |
-41.63 |
4.83 |
-9.22 |
-1.14 |
0 |
|
|
292772 |
117358470 |
1 |
ClFN2O2H8C10 |
ABC2D2E8F10 |
-41.2 |
4.16 |
-9.21 |
-1.03 |
0 |
|
|
292773 |
117358479 |
1 |
ClFN2O2H8C10 |
ABC2D2E8F10 |
-41.05 |
2.49 |
-9.17 |
-1.12 |
0 |
|
|
292774 |
117358482 |
1 |
ClFN2O2H8C10 |
ABC2D2E8F10 |
-45.84 |
4.48 |
-9.41 |
-0.81 |
0 |
|
|
292775 |
117358485 |
1 |
ClO4C11H11 |
AB4C11D11 |
-146.15 |
3.85 |
-9.7 |
-1.37 |
0 |
|
|
292776 |
117358497 |
1 |
ClO4C11H11 |
AB4C11D11 |
-147.0 |
2.75 |
-9.64 |
-1.35 |
0 |
|
|
292777 |
117358498 |
1 |
ClO4C11H11 |
AB4C11D11 |
-144.4 |
4.54 |
-9.49 |
-1.23 |
0 |
|
|
292778 |
117358562 |
1 |
ClO4C11H11 |
AB4C11D11 |
-151.13 |
5.47 |
-9.2 |
-0.62 |
0 |
|
|
292779 |
117358590 |
1 |
ClFO2C12H12 |
ABC2D12E12 |
-120.07 |
4.48 |
-9.54 |
-0.66 |
0 |
|
|
292780 |
117358607 |
1 |
ClFO2C12H12 |
ABC2D12E12 |
-130.95 |
2.93 |
-9.92 |
-0.78 |
0 |
|
|
292781 |
117358637 |
1 |
ClO3C12H15 |
AB3C12D15 |
-124.21 |
2.28 |
-8.84 |
-0.1 |
0 |
|
|
292782 |
117358648 |
1 |
ClO3C12H15 |
AB3C12D15 |
-129.17 |
4.57 |
-8.79 |
-0.12 |
0 |
|
|
292783 |
117358722 |
1 |
ClO3C12H15 |
AB3C12D15 |
-96.73 |
5.49 |
-8.98 |
-0.4 |
0 |
|
|
292784 |
117358750 |
1 |
ClO3C12H15 |
AB3C12D15 |
-102.48 |
2.12 |
-8.84 |
-0.25 |
0 |
|
|
292785 |
117358754 |
1 |
ClO3C12H15 |
AB3C12D15 |
-106.48 |
6.0 |
-8.9 |
-0.26 |
0 |
|
|
292786 |
117358761 |
1 |
ClO3C12H15 |
AB3C12D15 |
-122.7 |
2.63 |
-8.29 |
-0.05 |
0 |
|
|
292787 |
117358829 |
1 |
ClO3C12H15 |
AB3C12D15 |
-146.47 |
5.53 |
-9.38 |
-0.35 |
0 |
|
|
292788 |
117358833 |
1 |
ClO3C12H15 |
AB3C12D15 |
-128.52 |
2.6 |
-9.55 |
-0.4 |
0 |
|
|
292789 |
117358844 |
1 |
ClO3C12H15 |
AB3C12D15 |
-128.04 |
1.93 |
-8.92 |
-0.21 |
0 |
|
|
292790 |
117358850 |
1 |
ClO3C12H15 |
AB3C12D15 |
-127.2 |
3.64 |
-8.78 |
-0.27 |
0 |
|
|
292791 |
117358857 |
1 |
ClO3C12H15 |
AB3C12D15 |
-118.54 |
3.35 |
-8.9 |
-0.14 |
0 |
|
|
292792 |
117358869 |
1 |
ClN2O2C11H15 |
AB2C2D11E15 |
-73.96 |
6.75 |
-9.16 |
-0.58 |
0 |
|
|
292793 |
117358870 |
1 |
ClO3C12H15 |
AB3C12D15 |
-106.95 |
2.53 |
-8.62 |
0.04 |
0 |
|
|
292794 |
117358878 |
1 |
ClN2O2C11H15 |
AB2C2D11E15 |
-35.61 |
2.11 |
-8.74 |
-0.19 |
0 |
|
|
292795 |
117358939 |
1 |
ClO2C13H19 |
AB2C13D19 |
-101.04 |
2.21 |
-8.78 |
-0.14 |
0 |
|
|
292796 |
117358947 |
1 |
ClO2C13H19 |
AB2C13D19 |
-108.49 |
3.06 |
-8.81 |
-0.09 |
0 |
|
|
292797 |
117358981 |
1 |
BrO3H7C9 |
AB3C7D9 |
-89.99 |
4.95 |
-10.02 |
-1.71 |
0 |
|
|
292798 |
117358987 |
1 |
BrO2C10H11 |
AB2C10D11 |
-40.83 |
3.64 |
-9.14 |
-0.37 |
0 |
|
|
292799 |
117359015 |
1 |
BrO2C10H11 |
AB2C10D11 |
-55.34 |
2.04 |
-9.25 |
-0.42 |
0 |