List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
364992 |
127316642 |
1 |
O2N5C20H23 |
A2B5C20D23 |
-11.57 |
1.27 |
-9.4 |
-0.76 |
0 |
|
|
364993 |
127316643 |
1 |
O2N3C22H25 |
A2B3C22D25 |
5.19 |
5.12 |
-9.4 |
-1.12 |
0 |
|
|
364994 |
127316644 |
1 |
SO2N3C20H21 |
AB2C3D20E21 |
-26.72 |
2.86 |
-9.22 |
-1.23 |
0 |
|
|
364995 |
127316645 |
1 |
N2O3C21H22 |
A2B3C21D22 |
-81.2 |
4.96 |
-9.1 |
-0.79 |
0 |
|
|
364996 |
127316646 |
3 |
NOC7H9 |
ABC7D9 |
-130.79 |
6.88 |
-9.35 |
0.09 |
0 |
|
|
364997 |
127316647 |
1 |
O2N3C22H23 |
A2B3C22D23 |
-16.8 |
6.3 |
-9.24 |
-1.22 |
0 |
|
|
364998 |
127316648 |
1 |
N2O3C22H24 |
A2B3C22D24 |
-87.5 |
2.48 |
-8.88 |
-0.41 |
0 |
|
|
364999 |
127316649 |
1 |
O3N4C22H28 |
A3B4C22D28 |
-78.73 |
5.49 |
-8.98 |
-0.65 |
0 |
|
|
365000 |
127316650 |
1 |
O2N3C18H31 |
A2B3C18D31 |
-123.77 |
3.93 |
-8.69 |
1.13 |
0 |
|
|
365001 |
127316651 |
1 |
O3N4C18H26 |
A3B4C18D26 |
-96.52 |
5.77 |
-8.93 |
-0.23 |
0 |
|
|
365002 |
127316652 |
1 |
OSN3C13H19 |
ABC3D13E19 |
-19.03 |
3.96 |
-8.78 |
-0.82 |
0 |
|
|
365003 |
127316653 |
1 |
SO2N3C22H27 |
AB2C3D22E27 |
-52.34 |
4.52 |
-8.63 |
-0.74 |
0 |
|
|
365004 |
127316654 |
1 |
FO2N3C22H22 |
AB2C3D22E22 |
-41.46 |
8.23 |
-8.79 |
-1.22 |
0 |
|
|
365005 |
127316655 |
1 |
ClON5C18H22 |
ABC5D18E22 |
28.3 |
3.53 |
-8.57 |
-0.9 |
0 |
|
|
365006 |
127316656 |
1 |
N3O4C21H27 |
A3B4C21D27 |
-129.06 |
8.06 |
-8.95 |
-0.31 |
0 |
|
|
365007 |
127316657 |
1 |
ClON5C19H24 |
ABC5D19E24 |
21.06 |
4.41 |
-8.68 |
-0.97 |
0 |
|
|
365008 |
127316658 |
1 |
ON4C16H26 |
AB4C16D26 |
-26.6 |
4.59 |
-8.59 |
0.4 |
0 |
|
|
365009 |
127316659 |
1 |
ClON5C19H24 |
ABC5D19E24 |
19.27 |
5.48 |
-8.65 |
-0.91 |
0 |
|
|
365010 |
127316660 |
1 |
ON5C19H27 |
AB5C19D27 |
7.61 |
4.35 |
-8.81 |
-0.69 |
0 |
|
|
365011 |
127316661 |
1 |
O3N4C20H24 |
A3B4C20D24 |
-32.85 |
1.99 |
-8.91 |
-0.95 |
0 |
|
|
365012 |
127316662 |
1 |
ClO2N6C17H21 |
AB2C6D17E21 |
18.01 |
7.7 |
-8.93 |
-1.52 |
0 |
|
|
365013 |
127316663 |
1 |
ON4C12H18 |
AB4C12D18 |
-1.96 |
4.48 |
-8.9 |
-0.19 |
0 |
|
|
365014 |
127316664 |
1 |
ON5C21H23 |
AB5C21D23 |
59.57 |
6.65 |
-8.5 |
-1.32 |
0 |
|
|
365015 |
127316665 |
1 |
O2N4C17H28 |
A2B4C17D28 |
-56.09 |
5.47 |
-8.89 |
-0.12 |
0 |
|
|
365016 |
127316666 |
1 |
O2N4C21H26 |
A2B4C21D26 |
-23.08 |
1.95 |
-8.66 |
-0.12 |
0 |
|
|
365017 |
127316667 |
1 |
OSN2C15H22 |
ABC2D15E22 |
-36.41 |
4.7 |
-8.67 |
-0.36 |
0 |
|
|
365018 |
127316668 |
1 |
SN3O3C19H29 |
AB3C3D19E29 |
-115.53 |
6.04 |
-8.62 |
-0.3 |
0 |
|
|
365019 |
127316669 |
1 |
O2N3C22H25 |
A2B3C22D25 |
-37.29 |
6.09 |
-8.69 |
-0.52 |
0 |
|
|
365020 |
127316670 |
1 |
ON3C15H23 |
AB3C15D23 |
-32.03 |
3.98 |
-8.61 |
0.52 |
0 |
|
|
365021 |
127316671 |
1 |
O2N4C19H24 |
A2B4C19D24 |
-55.1 |
2.69 |
-8.77 |
-0.85 |
0 |
|
|
365022 |
127316672 |
1 |
S2N3O3C18H27 |
A2B3C3D18E27 |
-106.91 |
3.97 |
-8.8 |
-0.99 |
0 |
|
|
365023 |
127316673 |
1 |
FON2C16H21 |
ABC2D16E21 |
-78.41 |
4.78 |
-8.82 |
-0.38 |
0 |
|
|
365024 |
127316674 |
1 |
BrON4C18H21 |
ABC4D18E21 |
23.36 |
5.25 |
-8.99 |
-0.5 |
0 |
|
|
365025 |
127316675 |
1 |
ON5C17H21 |
AB5C17D21 |
36.85 |
4.79 |
-8.91 |
-1.06 |
0 |
|
|
365026 |
127316676 |
1 |
O3N4C19H30 |
A3B4C19D30 |
-151.08 |
2.48 |
-8.83 |
0.23 |
0 |
|
|
365027 |
127316677 |
1 |
ClON2C15H19 |
ABC2D15E19 |
-30.69 |
4.06 |
-8.72 |
-0.46 |
0 |
|
|
365028 |
127316678 |
1 |
ClON2C15H19 |
ABC2D15E19 |
-31.4 |
4.34 |
-8.84 |
-0.51 |
0 |
|
|
365029 |
127316679 |
1 |
ON3C14H19 |
AB3C14D19 |
-11.08 |
4.48 |
-8.85 |
-0.6 |
0 |
|
|
365030 |
127316680 |
1 |
OSN2C14H20 |
ABC2D14E20 |
-27.81 |
4.24 |
-8.68 |
-0.42 |
0 |
|
|
365031 |
127316681 |
1 |
ClON2C15H19 |
ABC2D15E19 |
-31.09 |
4.69 |
-8.84 |
-0.48 |
0 |
|
|
365032 |
127316682 |
1 |
SN3O3C20H31 |
AB3C3D20E31 |
-127.27 |
6.29 |
-8.63 |
-0.65 |
0 |
|
|
365033 |
127316683 |
1 |
SN3O3C19H29 |
AB3C3D19E29 |
-122.09 |
7.33 |
-8.86 |
-0.32 |
0 |
|
|
365034 |
127316684 |
1 |
N3O3C19H29 |
A3B3C19D29 |
-146.87 |
3.28 |
-8.67 |
0.08 |
0 |
|
|
365035 |
127316685 |
1 |
SN3O3C20H31 |
AB3C3D20E31 |
-123.04 |
5.38 |
-8.83 |
-0.39 |
0 |
|
|
365036 |
127316686 |
1 |
ON3C16H25 |
AB3C16D25 |
-41.77 |
5.65 |
-8.4 |
0.9 |
0 |
|
|
365037 |
127316687 |
1 |
SO2N4C21H26 |
AB2C4D21E26 |
-38.17 |
3.52 |
-8.76 |
-0.38 |
0 |
|
|
365038 |
127316688 |
1 |
ON5C23H29 |
AB5C23D29 |
29.86 |
5.11 |
-8.79 |
-0.13 |
0 |
|
|
365039 |
127316689 |
1 |
SN3O3C20H29 |
AB3C3D20E29 |
-107.9 |
4.61 |
-8.74 |
-0.33 |
0 |
|
|
365040 |
127316690 |
1 |
SN3O3C16H29 |
AB3C3D16E29 |
-151.74 |
3.2 |
-8.59 |
0.33 |
0 |
|
|
365041 |
127316691 |
1 |
N3O3C23H33 |
A3B3C23D33 |
-119.22 |
6.68 |
-8.87 |
0.28 |
0 |
|
|
365042 |
127316692 |
1 |
O2N3C13H21 |
A2B3C13D21 |
-94.36 |
2.57 |
-8.85 |
0.54 |
0 |
|
|
365043 |
127316703 |
1 |
O2N4C23H32 |
A2B4C23D32 |
-10.72 |
6.72 |
-9.02 |
-1.07 |
0 |
|
|
365044 |
127316704 |
1 |
O2N3C17H29 |
A2B3C17D29 |
-116.85 |
0.9 |
-8.69 |
0.88 |
0 |
|
|
365045 |
127316724 |
1 |
OF2N2C15H18 |
AB2C2D15E18 |
-112.8 |
4.83 |
-8.9 |
-0.7 |
0 |
|
|
365046 |
127316725 |
1 |
ON2C16H22 |
AB2C16D22 |
-31.37 |
4.6 |
-8.73 |
0.0 |
0 |
|
|
365047 |
127316726 |
1 |
N3O3C19H29 |
A3B3C19D29 |
-149.74 |
5.56 |
-8.73 |
0.01 |
0 |
|
|
365048 |
127316727 |
1 |
ON2C14H24 |
AB2C14D24 |
-65.25 |
3.94 |
-8.72 |
1.29 |
0 |
|
|
365049 |
127316728 |
1 |
O2N3C13H21 |
A2B3C13D21 |
-94.37 |
2.58 |
-8.86 |
0.54 |
0 |
|
|
365050 |
127316729 |
1 |
SN3O3C19H29 |
AB3C3D19E29 |
-123.54 |
7.68 |
-8.89 |
-0.41 |
0 |
|
|
365051 |
127316732 |
1 |
BrON4C18H21 |
ABC4D18E21 |
26.27 |
4.27 |
-8.88 |
-0.34 |
0 |
|
|
365052 |
127316733 |
1 |
ON3C16H23 |
AB3C16D23 |
-33.41 |
4.77 |
-8.79 |
-0.23 |
0 |
|
|
365053 |
127316734 |
3 |
NOC6H9 |
ABC6D9 |
-142.59 |
5.15 |
-8.6 |
-0.04 |
0 |
|
|
365054 |
127316735 |
1 |
O2N3C13H19 |
A2B3C13D19 |
-29.93 |
5.47 |
-8.82 |
-0.16 |
0 |
|
|
365055 |
127316736 |
1 |
O2N3C22H31 |
A2B3C22D31 |
-83.3 |
2.2 |
-8.81 |
-0.38 |
0 |
|
|
365056 |
127316737 |
1 |
O2F3N4C18H19 |
A2B3C4D18E19 |
-140.53 |
4.62 |
-8.9 |
-1.56 |
0 |
|
|
365057 |
127316738 |
1 |
ON4C14H22 |
AB4C14D22 |
-13.92 |
5.28 |
-8.66 |
0.32 |
0 |
|
|
365058 |
127316739 |
1 |
OSN2C14H24 |
ABC2D14E24 |
-61.16 |
4.82 |
-8.35 |
0.98 |
0 |
|
|
365059 |
127316740 |
1 |
ON2C15H26 |
AB2C15D26 |
-69.51 |
3.97 |
-8.69 |
1.32 |
0 |
|
|
365060 |
127316774 |
1 |
ON3C13H19 |
AB3C13D19 |
-20.68 |
4.88 |
-8.57 |
0.58 |
0 |
|
|
365061 |
127316775 |
1 |
ON4C16H26 |
AB4C16D26 |
-24.54 |
4.41 |
-8.64 |
0.47 |
0 |
|
|
365062 |
127316776 |
1 |
SN3O3C17H31 |
AB3C3D17E31 |
-153.56 |
5.12 |
-8.75 |
0.19 |
0 |
|
|
365063 |
127316777 |
1 |
OF4N5C18H19 |
AB4C5D18E19 |
-157.09 |
3.56 |
-8.82 |
-1.32 |
0 |
|
|
365064 |
127316778 |
1 |
ON3C14H21 |
AB3C14D21 |
-30.47 |
4.92 |
-8.58 |
0.6 |
0 |
|
|
365065 |
127316779 |
1 |
O3N5C21H27 |
A3B5C21D27 |
-90.68 |
4.61 |
-8.64 |
-1.27 |
0 |
|
|
365066 |
127316780 |
1 |
O2F3N3C15H22 |
A2B3C3D15E22 |
-257.78 |
6.31 |
-8.97 |
0.5 |
0 |
|
|
365067 |
127316781 |
1 |
OF2N2C15H18 |
AB2C2D15E18 |
-115.31 |
4.87 |
-8.76 |
-0.7 |
0 |
|
|
365068 |
127316782 |
1 |
SN3O4C17H27 |
AB3C4D17E27 |
-181.15 |
8.41 |
-9.06 |
0.54 |
0 |
|
|
365069 |
127316783 |
1 |
SO2N4C20H24 |
AB2C4D20E24 |
-27.49 |
7.53 |
-8.29 |
-0.9 |
0 |
|
|
365070 |
127316784 |
1 |
ON4C14H22 |
AB4C14D22 |
-15.22 |
4.44 |
-8.6 |
0.4 |
0 |
|
|
365071 |
127316785 |
1 |
ON3C15H21 |
AB3C15D21 |
-22.22 |
4.31 |
-8.79 |
-0.44 |
0 |
|
|
365072 |
127316814 |
1 |
N2O2C15H22 |
A2B2C15D22 |
-75.25 |
3.96 |
-8.62 |
0.37 |
0 |
|
|
365073 |
127316815 |
1 |
ON2C15H26 |
AB2C15D26 |
-71.06 |
3.92 |
-8.73 |
1.16 |
0 |
|
|
365074 |
127316816 |
1 |
SN3O4C19H27 |
AB3C4D19E27 |
-139.23 |
6.38 |
-8.82 |
-0.83 |
0 |
|
|
365075 |
127316817 |
2 |
ON3C8H11 |
AB3C8D11 |
-26.33 |
1.34 |
-8.81 |
-0.73 |
0 |
|
|
365076 |
127316818 |
1 |
SN3O3C20H29 |
AB3C3D20E29 |
-110.94 |
3.58 |
-8.7 |
-0.64 |
0 |
|
|
365077 |
127316819 |
1 |
SO2N4C18H24 |
AB2C4D18E24 |
-62.6 |
3.79 |
-8.81 |
-1.08 |
0 |
|
|
365078 |
127316820 |
1 |
ClON3C14H20 |
ABC3D14E20 |
-30.48 |
4.32 |
-8.8 |
0.13 |
0 |
|
|
365079 |
127316821 |
1 |
ON4C13H20 |
AB4C13D20 |
-3.47 |
5.68 |
-8.7 |
0.26 |
0 |
|
|
365080 |
127316822 |
1 |
SO2N4C19H24 |
AB2C4D19E24 |
-61.24 |
5.63 |
-8.64 |
-1.11 |
0 |
|
|
365081 |
127316823 |
1 |
O2N3C14H23 |
A2B3C14D23 |
-97.97 |
0.28 |
-8.72 |
0.66 |
0 |
|
|
365082 |
127316824 |
1 |
N3O3C22H33 |
A3B3C22D33 |
-143.82 |
3.54 |
-8.65 |
0.02 |
0 |
|
|
365083 |
127316825 |
1 |
SN3O3C21H25 |
AB3C3D21E25 |
-71.22 |
4.5 |
-8.87 |
-1.02 |
0 |
|
|
365084 |
127316826 |
1 |
O2N6C17H22 |
A2B6C17D22 |
-1.29 |
3.81 |
-8.75 |
-1.36 |
0 |
|
|
365085 |
127316827 |
1 |
ClOSN2C13H17 |
ABCD2E13F17 |
-18.89 |
4.15 |
-8.81 |
-0.87 |
0 |
|
|
365086 |
127316828 |
1 |
ON2C15H26 |
AB2C15D26 |
-71.22 |
3.7 |
-8.67 |
1.31 |
0 |
|
|
365087 |
127316829 |
1 |
OSN6C15H24 |
ABC6D15E24 |
43.09 |
7.48 |
-8.99 |
-0.7 |
0 |
|
|
365088 |
127316830 |
1 |
ON6C20H28 |
AB6C20D28 |
44.03 |
3.18 |
-8.92 |
-0.58 |
0 |
|
|
365089 |
127316831 |
1 |
OCl2N5C18H21 |
AB2C5D18E21 |
18.48 |
6.16 |
-8.57 |
-1.13 |
0 |
|
|
365090 |
127316832 |
1 |
O2N3C22H23 |
A2B3C22D23 |
2.49 |
5.56 |
-8.94 |
-0.9 |
0 |
|
|
365091 |
127316833 |
1 |
ON4C16H20 |
AB4C16D20 |
6.11 |
3.93 |
-8.72 |
-0.52 |
0 |