List Systems
Back
Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
364717 |
127316023 |
2 |
ON2C7H11 |
AB2C7D11 |
-66.31 |
4.61 |
-9.06 |
0.54 |
0 |
|
|
364718 |
127316024 |
1 |
SO3N4C15H24 |
AB3C4D15E24 |
-104.02 |
7.52 |
-8.97 |
0.2 |
0 |
|
|
364719 |
127316025 |
1 |
SO3N5C13H21 |
AB3C5D13E21 |
-90.87 |
1.56 |
-9.08 |
0.01 |
0 |
|
|
364720 |
127316026 |
1 |
O2N6C19H30 |
A2B6C19D30 |
-69.86 |
3.89 |
-8.97 |
0.75 |
0 |
|
|
364721 |
127316027 |
1 |
O2N6C17H26 |
A2B6C17D26 |
-16.3 |
5.85 |
-9.22 |
-0.2 |
0 |
|
|
364722 |
127316028 |
1 |
O3N6C16H24 |
A3B6C16D24 |
-87.98 |
3.9 |
-9.12 |
-0.37 |
0 |
|
|
364723 |
127316029 |
2 |
ON3C8H9 |
AB3C8D9 |
39.42 |
6.62 |
-9.29 |
-1.23 |
0 |
|
|
364724 |
127316030 |
1 |
OSN8C14H20 |
ABC8D14E20 |
89.76 |
6.12 |
-9.21 |
-0.51 |
0 |
|
|
364725 |
127316031 |
1 |
ON4C19H24 |
AB4C19D24 |
0.11 |
1.82 |
-9.01 |
0.23 |
0 |
|
|
364726 |
127316032 |
1 |
FON5C19H20 |
ABC5D19E20 |
-13.66 |
5.3 |
-9.24 |
-1.19 |
0 |
|
|
364727 |
127316033 |
1 |
ON7C18H23 |
AB7C18D23 |
50.03 |
4.99 |
-9.13 |
-0.81 |
0 |
|
|
364728 |
127316034 |
1 |
ON7C17H21 |
AB7C17D21 |
52.72 |
0.61 |
-9.26 |
-0.9 |
0 |
|
|
364729 |
127316035 |
1 |
O3N5C18H19 |
A3B5C18D19 |
-49.57 |
4.23 |
-9.35 |
-1.7 |
0 |
|
|
364730 |
127316036 |
1 |
ON7C21H29 |
AB7C21D29 |
32.06 |
3.55 |
-9.16 |
-0.69 |
0 |
|
|
364731 |
127316037 |
1 |
O3N6C19H28 |
A3B6C19D28 |
-112.06 |
3.77 |
-9.05 |
-0.08 |
0 |
|
|
364732 |
127316038 |
1 |
ON8C18H24 |
AB8C18D24 |
55.49 |
5.69 |
-9.3 |
-0.95 |
0 |
|
|
364733 |
127316039 |
1 |
SO2N6C17H22 |
AB2C6D17E22 |
-21.61 |
7.03 |
-8.82 |
-0.69 |
0 |
|
|
364734 |
127316040 |
1 |
SO2N5C18H21 |
AB2C5D18E21 |
-30.41 |
6.01 |
-8.95 |
-0.93 |
0 |
|
|
364735 |
127316041 |
1 |
ON5C22H27 |
AB5C22D27 |
7.98 |
5.08 |
-8.4 |
-0.12 |
0 |
|
|
364736 |
127316042 |
1 |
O3N4C18H22 |
A3B4C18D22 |
-64.88 |
6.35 |
-8.88 |
-0.18 |
0 |
|
|
364737 |
127316043 |
1 |
ON4C19H24 |
AB4C19D24 |
-3.3 |
6.16 |
-9.0 |
0.12 |
0 |
|
|
364738 |
127316044 |
1 |
ON6C22H26 |
AB6C22D26 |
57.88 |
7.3 |
-8.86 |
-0.51 |
0 |
|
|
364739 |
127316045 |
1 |
ON4C18H22 |
AB4C18D22 |
5.46 |
3.41 |
-9.04 |
-0.05 |
0 |
|
|
364740 |
127316046 |
1 |
O2N6C17H20 |
A2B6C17D20 |
35.22 |
6.17 |
-9.3 |
-1.25 |
0 |
|
|
364741 |
127316047 |
1 |
SO2N4C16H26 |
AB2C4D16E26 |
-69.45 |
3.01 |
-8.56 |
0.29 |
0 |
|
|
364742 |
127316048 |
2 |
ON2C8H13 |
AB2C8D13 |
-76.76 |
1.55 |
-9.01 |
0.65 |
0 |
|
|
364743 |
127316049 |
1 |
ON7C17H23 |
AB7C17D23 |
41.86 |
8.73 |
-8.84 |
-0.56 |
0 |
|
|
364744 |
127316050 |
1 |
OSN6C16H22 |
ABC6D16E22 |
28.12 |
4.62 |
-8.52 |
-0.11 |
0 |
|
|
364745 |
127316051 |
1 |
O2N5C16H21 |
A2B5C16D21 |
3.02 |
5.68 |
-9.12 |
-0.4 |
0 |
|
|
364746 |
127316052 |
1 |
ON7C16H19 |
AB7C16D19 |
63.41 |
7.13 |
-9.34 |
-1.14 |
0 |
|
|
364747 |
127316053 |
2 |
ON3C9H12 |
AB3C9D12 |
-11.26 |
4.09 |
-8.89 |
-0.54 |
0 |
|
|
364748 |
127316054 |
1 |
O2N5C20H31 |
A2B5C20D31 |
-75.28 |
5.29 |
-8.76 |
0.77 |
0 |
|
|
364749 |
127316055 |
1 |
O2N5C21H33 |
A2B5C21D33 |
-89.02 |
8.41 |
-9.1 |
0.63 |
0 |
|
|
364750 |
127316056 |
1 |
ON8C18H24 |
AB8C18D24 |
60.83 |
4.37 |
-8.78 |
-0.05 |
0 |
|
|
364751 |
127316057 |
1 |
O2N5C17H27 |
A2B5C17D27 |
-76.91 |
3.6 |
-9.15 |
0.58 |
0 |
|
|
364752 |
127316058 |
1 |
OSN5C18H21 |
ABC5D18E21 |
25.04 |
2.9 |
-8.88 |
-0.95 |
0 |
|
|
364753 |
127316059 |
1 |
O2N4C15H24 |
A2B4C15D24 |
-69.8 |
4.08 |
-9.12 |
0.62 |
0 |
|
|
364754 |
127316060 |
1 |
O3N4C13H20 |
A3B4C13D20 |
-88.42 |
5.19 |
-9.11 |
0.56 |
0 |
|
|
364755 |
127316086 |
1 |
O3N4C16H18 |
A3B4C16D18 |
-44.65 |
5.42 |
-9.04 |
-0.62 |
0 |
|
|
364756 |
127316087 |
2 |
ON2C10H13 |
AB2C10D13 |
-33.61 |
3.32 |
-9.12 |
0.02 |
0 |
|
|
364757 |
127316088 |
1 |
ON6C19H24 |
AB6C19D24 |
40.98 |
5.69 |
-8.45 |
-0.2 |
0 |
|
|
364758 |
127316089 |
1 |
FON4C20H25 |
ABC4D20E25 |
-45.77 |
5.0 |
-9.02 |
-0.35 |
0 |
|
|
364759 |
127316090 |
1 |
ON7C13H19 |
AB7C13D19 |
46.24 |
2.97 |
-9.34 |
0.04 |
0 |
|
|
364760 |
127316091 |
1 |
SO3N5C14H23 |
AB3C5D14E23 |
-93.65 |
8.08 |
-9.31 |
0.54 |
0 |
|
|
364761 |
127316092 |
1 |
O2N5C15H23 |
A2B5C15D23 |
-66.66 |
5.36 |
-8.98 |
0.48 |
0 |
|
|
364762 |
127316093 |
1 |
SO3N5C18H23 |
AB3C5D18E23 |
-64.32 |
8.75 |
-8.81 |
-0.31 |
0 |
|
|
364763 |
127316094 |
1 |
ON4C21H32 |
AB4C21D32 |
-53.34 |
5.12 |
-8.95 |
0.72 |
0 |
|
|
364764 |
127316095 |
1 |
O3N5C19H23 |
A3B5C19D23 |
-64.21 |
3.87 |
-8.9 |
-0.45 |
0 |
|
|
364765 |
127316096 |
1 |
ON7C17H21 |
AB7C17D21 |
54.75 |
3.17 |
-9.07 |
-0.69 |
0 |
|
|
364766 |
127316097 |
1 |
OSN4C16H20 |
ABC4D16E20 |
16.26 |
3.48 |
-8.96 |
-0.6 |
0 |
|
|
364767 |
127316098 |
1 |
O3N6C17H20 |
A3B6C17D20 |
-40.88 |
5.33 |
-9.0 |
-1.08 |
0 |
|
|
364768 |
127316099 |
1 |
O2N5C19H23 |
A2B5C19D23 |
-32.78 |
3.94 |
-8.87 |
-0.31 |
0 |
|
|
364769 |
127316100 |
1 |
O3N6C17H24 |
A3B6C17D24 |
-78.13 |
5.12 |
-9.03 |
-0.11 |
0 |
|
|
364770 |
127316101 |
1 |
O3N5C19H23 |
A3B5C19D23 |
-58.93 |
6.56 |
-9.04 |
-0.33 |
0 |
|
|
364771 |
127316102 |
1 |
O3N6C18H26 |
A3B6C18D26 |
-107.33 |
7.39 |
-9.1 |
-0.09 |
0 |
|
|
364772 |
127316103 |
1 |
O3N7C17H19 |
A3B7C17D19 |
-57.57 |
3.28 |
-9.28 |
-1.47 |
0 |
|
|
364773 |
127316111 |
2 |
ON2C11H15 |
AB2C11D15 |
-45.98 |
4.0 |
-8.76 |
0.15 |
0 |
|
|
364774 |
127316112 |
1 |
O2N4C21H28 |
A2B4C21D28 |
-42.33 |
5.27 |
-9.09 |
0.08 |
0 |
|
|
364775 |
127316113 |
1 |
O2N5C17H27 |
A2B5C17D27 |
-78.0 |
5.19 |
-9.06 |
0.45 |
0 |
|
|
364776 |
127316114 |
1 |
ON6C14H20 |
AB6C14D20 |
28.16 |
3.21 |
-9.12 |
0.63 |
0 |
|
|
364777 |
127316115 |
1 |
SO3N5C17H29 |
AB3C5D17E29 |
-117.5 |
5.25 |
-9.11 |
0.09 |
0 |
|
|
364778 |
127316116 |
1 |
ON6C17H20 |
AB6C17D20 |
43.86 |
2.55 |
-8.98 |
-0.83 |
0 |
|
|
364779 |
127316117 |
1 |
O2N5C18H29 |
A2B5C18D29 |
-76.24 |
6.54 |
-9.09 |
0.44 |
0 |
|
|
364780 |
127316118 |
1 |
ON6C19H28 |
AB6C19D28 |
29.17 |
4.66 |
-8.87 |
0.32 |
0 |
|
|
364781 |
127316119 |
1 |
SO3N5C17H29 |
AB3C5D17E29 |
-113.83 |
3.49 |
-9.07 |
0.17 |
0 |
|
|
364782 |
127316120 |
1 |
O2N5C17H27 |
A2B5C17D27 |
-70.73 |
6.55 |
-9.12 |
0.46 |
0 |
|
|
364783 |
127316121 |
1 |
O2N5C19H25 |
A2B5C19D25 |
-15.09 |
5.09 |
-8.21 |
-0.07 |
0 |
|
|
364784 |
127316122 |
2 |
ON3C9H10 |
AB3C9D10 |
-7.51 |
9.55 |
-8.88 |
-1.41 |
0 |
|
|
364785 |
127316123 |
1 |
ON6C15H20 |
AB6C15D20 |
49.75 |
4.01 |
-8.95 |
0.13 |
0 |
|
|
364786 |
127316124 |
1 |
O3N7C18H21 |
A3B7C18D21 |
-54.39 |
3.57 |
-9.29 |
-1.42 |
0 |
|
|
364787 |
127316125 |
1 |
O3N4C18H22 |
A3B4C18D22 |
-59.48 |
4.76 |
-8.86 |
0.0 |
0 |
|
|
364788 |
127316126 |
1 |
ON5C21H23 |
AB5C21D23 |
32.33 |
4.37 |
-9.14 |
-0.82 |
0 |
|
|
364789 |
127316127 |
1 |
ON8C16H20 |
AB8C16D20 |
71.21 |
7.24 |
-9.16 |
-1.11 |
0 |
|
|
364790 |
127316128 |
1 |
FO2N5C19H22 |
AB2C5D19E22 |
-70.68 |
5.82 |
-8.97 |
-0.25 |
0 |
|
|
364791 |
127316129 |
1 |
ClON4C20H25 |
ABC4D20E25 |
-7.53 |
3.06 |
-9.07 |
-0.4 |
0 |