List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
55051 |
17389703 |
1 |
NCl2O2C14H21 |
AB2C2D14E21 |
-112.87 |
4.96 |
-8.69 |
-0.22 |
0 |
|
|
55052 |
17389704 |
1 |
ClNO2C14H20 |
ABC2D14E20 |
-75.12 |
4.43 |
-8.36 |
0.03 |
0 |
|
|
55053 |
17389706 |
1 |
NOCl2C12H17 |
ABC2D12E17 |
-75.64 |
2.03 |
-9.04 |
-0.38 |
0 |
|
|
55054 |
17389707 |
1 |
ClNOC12H16 |
ABCD12E16 |
-37.41 |
0.72 |
-8.75 |
-0.14 |
0 |
|
|
55055 |
17389708 |
1 |
ClNO5C12H12 |
ABC5D12E12 |
-182.58 |
7.98 |
-9.83 |
-1.39 |
0 |
|
|
55056 |
17389709 |
1 |
FNC18H20 |
ABC18D20 |
-40.51 |
4.73 |
-8.59 |
-0.14 |
0 |
|
|
55057 |
17389710 |
1 |
NC19H23 |
AB19C23 |
0.43 |
2.14 |
-8.24 |
0.27 |
0 |
|
|
55058 |
17389711 |
1 |
NSH13C14 |
ABC13D14 |
47.77 |
2.33 |
-8.15 |
-0.36 |
0 |
|
|
55059 |
17389713 |
1 |
NO4C15H19 |
AB4C15D19 |
-159.87 |
5.0 |
-9.62 |
-0.12 |
0 |
|
|
55060 |
17389714 |
1 |
NO5C16H23 |
AB5C16D23 |
-195.69 |
2.5 |
-8.58 |
-1.43 |
0 |
|
|
55061 |
17389715 |
1 |
BrClNO2C14H21 |
ABCD2E14F21 |
-98.08 |
4.06 |
-8.59 |
-0.29 |
0 |
|
|
55062 |
17389716 |
1 |
BrNO2C14H20 |
ABC2D14E20 |
-63.0 |
4.27 |
-8.43 |
-0.03 |
0 |
|
|
55063 |
17389719 |
1 |
BrNOC12H16 |
ABCD12E16 |
-27.66 |
2.6 |
-8.8 |
-0.17 |
0 |
|
|
55064 |
17389720 |
1 |
ClN4C9H11 |
AB4C9D11 |
33.7 |
3.09 |
-9.0 |
-0.61 |
0 |
|
|
55065 |
17389721 |
1 |
ClNSO2C7H10 |
ABCD2E7F10 |
-93.51 |
6.41 |
-9.52 |
-1.26 |
0 |
|
|
55066 |
17389722 |
2 |
ClON2C5H8 |
ABC2D5E8 |
-48.36 |
0.95 |
-9.48 |
-1.52 |
0 |
|
|
55067 |
17389724 |
1 |
NO2H21C23 |
AB2C21D23 |
5.74 |
1.76 |
-9.37 |
-0.08 |
0 |
|
|
55068 |
17389725 |
1 |
ClN3O3C10H12 |
AB3C3D10E12 |
-67.48 |
5.79 |
-9.6 |
-0.83 |
0 |
|
|
55069 |
17389726 |
1 |
ClSO2N3C11H14 |
ABC2D3E11F14 |
-47.66 |
7.83 |
-9.23 |
-1.1 |
0 |
|
|
55070 |
17389727 |
1 |
NSBr2C9H13 |
ABC2D9E13 |
7.01 |
2.71 |
-9.23 |
-0.42 |
0 |
|
|
55071 |
17389728 |
1 |
NSBr2C10H15 |
ABC2D10E15 |
-3.76 |
3.65 |
-9.24 |
-0.42 |
0 |
|
|
55072 |
17389729 |
2 |
NO4C8H11 |
AB4C8D11 |
-319.66 |
3.95 |
-8.43 |
-1.57 |
0 |
|
|
55073 |
17389730 |
2 |
NO4C8H11 |
AB4C8D11 |
-342.94 |
11.74 |
-8.83 |
-0.8 |
0 |
|
|
55074 |
17389731 |
2 |
NC6H9 |
AB6C9 |
6.82 |
2.2 |
-8.27 |
0.6 |
0 |
|
|
55075 |
17389732 |
2 |
NO4C8H11 |
AB4C8D11 |
-321.13 |
6.86 |
-8.94 |
-1.17 |
0 |
|
|
55076 |
17389733 |
2 |
NC6H9 |
AB6C9 |
9.47 |
2.62 |
-7.85 |
0.67 |
0 |
|
|
55077 |
17389735 |
1 |
N2C13H20 |
A2B13C20 |
4.32 |
2.41 |
-8.16 |
0.47 |
0 |
|
|
55078 |
17389737 |
1 |
ON2C12H18 |
AB2C12D18 |
-20.14 |
1.76 |
-7.88 |
0.46 |
0 |
|
|
55079 |
17389740 |
1 |
BrN2O8C15H19 |
AB2C8D15E19 |
-306.45 |
8.73 |
-8.22 |
-1.74 |
0 |
|
|
55080 |
17389741 |
1 |
BrN2C11H15 |
AB2C11D15 |
19.07 |
5.42 |
-8.25 |
0.23 |
0 |
|
|
55081 |
17389742 |
1 |
FN2O8C15H19 |
AB2C8D15E19 |
-357.61 |
3.02 |
-8.88 |
-1.49 |
0 |
|
|
55082 |
17389743 |
1 |
FN2C11H15 |
AB2C11D15 |
-30.55 |
5.28 |
-8.22 |
0.2 |
0 |
|
|
55083 |
17389744 |
1 |
Cl2N2O4C13H16 |
A2B2C4D13E16 |
-174.99 |
10.96 |
-8.91 |
-0.38 |
0 |
|
|
55084 |
17389745 |
1 |
Cl2N2C11H14 |
A2B2C11D14 |
-3.21 |
3.99 |
-8.55 |
-0.2 |
0 |
|
|
55085 |
17389746 |
1 |
ClN2O8C16H21 |
AB2C8D16E21 |
-331.09 |
4.9 |
-8.65 |
-1.31 |
0 |
|
|
55086 |
17389747 |
1 |
ClN2C12H17 |
AB2C12D17 |
-0.94 |
5.06 |
-8.22 |
0.33 |
0 |
|
|
55087 |
17389748 |
2 |
ClNC6H9 |
ABC6D9 |
-37.41 |
4.74 |
-8.47 |
-0.11 |
0 |
|
|
55088 |
17389751 |
1 |
N2C13H20 |
A2B13C20 |
-3.99 |
2.43 |
-8.23 |
0.75 |
0 |
|
|
55089 |
17389752 |
1 |
N2O9C16H22 |
A2B9C16D22 |
-347.77 |
4.66 |
-8.45 |
-1.36 |
0 |
|
|
55090 |
17389753 |
1 |
ON2C12H18 |
AB2C12D18 |
-21.71 |
2.56 |
-7.85 |
0.32 |
0 |
|
|
55091 |
17389754 |
1 |
ClN2F3O8C16H18 |
AB2C3D8E16F18 |
-480.34 |
7.06 |
-8.74 |
-1.23 |
0 |
|
|
55092 |
17389755 |
1 |
ClN2F3C12H14 |
AB2C3D12E14 |
-155.05 |
5.15 |
-8.61 |
-0.55 |
0 |
|
|
55093 |
17389756 |
2 |
NO4C8H11 |
AB4C8D11 |
-298.39 |
3.77 |
-8.98 |
-1.51 |
0 |
|
|
55094 |
17389757 |
1 |
NOCl2C12H17 |
ABC2D12E17 |
-71.09 |
3.97 |
-8.77 |
-0.09 |
0 |
|
|
55095 |
17389758 |
1 |
ClNOC12H16 |
ABCD12E16 |
-39.2 |
2.56 |
-8.75 |
-0.17 |
0 |
|
|
55096 |
17389759 |
1 |
ClNOC12H18 |
ABCD12E18 |
-62.44 |
1.78 |
-9.07 |
-0.11 |
0 |
|
|
55097 |
17389760 |
1 |
NO4C10H19 |
AB4C10D19 |
-187.43 |
2.24 |
-9.14 |
-1.36 |
0 |
|
|
55098 |
17389762 |
1 |
FN2O2C11H11 |
AB2C2D11E11 |
-112.7 |
2.43 |
-9.17 |
-0.44 |
0 |
|
|
55099 |
17389763 |
1 |
N2O2C13H16 |
A2B2C13D16 |
-79.08 |
1.41 |
-8.82 |
-0.09 |
0 |
|
|
55100 |
17389764 |
1 |
BrN2O2C11H11 |
AB2C2D11E11 |
-63.52 |
2.93 |
-9.17 |
-0.58 |
0 |
|
|
55101 |
17389765 |
2 |
NOC6H7 |
ABC6D7 |
-74.83 |
1.85 |
-8.8 |
-0.11 |
0 |
|
|
55102 |
17389766 |
1 |
N2O3C13H16 |
A2B3C13D16 |
-111.31 |
2.63 |
-8.49 |
-0.09 |
0 |
|
|
55103 |
17389767 |
1 |
N2O3C12H14 |
A2B3C12D14 |
-107.8 |
2.23 |
-8.86 |
-0.24 |
0 |
|
|
55104 |
17389769 |
1 |
N2O2C13H16 |
A2B2C13D16 |
-81.11 |
7.48 |
-8.77 |
-0.08 |
0 |
|
|
55105 |
17389770 |
1 |
ClN2O2F3H10C12 |
AB2C2D3E10F12 |
-233.73 |
4.17 |
-9.7 |
-1.17 |
0 |
|
|
55106 |
17389772 |
1 |
ClN2O2C12H13 |
AB2C2D12E13 |
-84.74 |
2.03 |
-9.02 |
-0.39 |
0 |
|
|
55107 |
17389773 |
1 |
NO6C15H19 |
AB6C15D19 |
-221.9 |
2.7 |
-8.59 |
-1.23 |
0 |
|
|
55108 |
17389774 |
1 |
ClNO4C14H18 |
ABC4D14E18 |
-174.3 |
12.31 |
-9.59 |
-0.82 |
0 |
|
|
55109 |
17389775 |
1 |
ClNC12H16 |
ABC12D16 |
2.04 |
2.45 |
-8.79 |
0.16 |
0 |
|
|
55110 |
17389776 |
1 |
BrNO2H12C13 |
ABC2D12E13 |
-35.71 |
3.43 |
-9.31 |
-0.99 |
0 |
|
|
55111 |
17389777 |
2 |
NOH9C11 |
ABC9D11 |
14.4 |
4.31 |
-9.23 |
-1.07 |
0 |
|
|
55112 |
17389778 |
1 |
O2N3C11H11 |
A2B3C11D11 |
-11.81 |
4.65 |
-9.32 |
-1.23 |
0 |
|
|
55113 |
17389780 |
1 |
N2O2H18C21 |
A2B2C18D21 |
-8.74 |
5.77 |
-9.1 |
-0.96 |
0 |
|
|
55114 |
17389781 |
2 |
NOC6H7 |
ABC6D7 |
-49.51 |
6.21 |
-9.68 |
-0.64 |
0 |
|
|
55115 |
17389782 |
2 |
NOC7H8 |
ABC7D8 |
-33.42 |
3.52 |
-9.33 |
-1.09 |
0 |
|
|
55116 |
17389783 |
2 |
NOH11C12 |
ABC11D12 |
7.91 |
3.19 |
-9.12 |
-1.28 |
0 |
|
|
55117 |
17389784 |
1 |
ClON2C11H17 |
ABC2D11E17 |
-57.34 |
5.52 |
-9.52 |
-1.21 |
0 |
|
|
55118 |
17389785 |
1 |
ON2C11H16 |
AB2C11D16 |
-17.86 |
3.68 |
-9.48 |
-0.93 |
0 |
|
|
55119 |
17389786 |
1 |
ClON2C11H17 |
ABC2D11E17 |
-50.08 |
3.62 |
-9.51 |
-0.84 |
0 |
|
|
55120 |
17389787 |
1 |
N2O4C21H24 |
A2B4C21D24 |
-124.11 |
2.83 |
-8.29 |
-1.46 |
0 |
|
|
55121 |
17389788 |
1 |
NF5C14H16 |
AB5C14D16 |
-241.69 |
2.84 |
-9.34 |
0.0 |
0 |
|
|
55122 |
17389789 |
1 |
ClN2C13H21 |
AB2C13D21 |
-34.72 |
1.98 |
-8.31 |
0.2 |
0 |
|
|
55123 |
17389791 |
1 |
FN2O4C16H23 |
AB2C4D16E23 |
-206.05 |
1.99 |
-9.24 |
-0.91 |
0 |
|
|
55124 |
17389793 |
1 |
NO5C8H17 |
AB5C8D17 |
-230.12 |
3.55 |
-9.73 |
-1.51 |
0 |
|
|
55125 |
17389795 |
1 |
NO7C12H17 |
AB7C12D17 |
-268.04 |
3.0 |
-8.96 |
-1.15 |
0 |