List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
290700 |
109817158 |
1 |
IO2N4C20H39 |
AB2C4D20E39 |
-117.92 |
6.03 |
-9.36 |
0.73 |
0 |
|
|
290701 |
109817159 |
2 |
ON2C10H19 |
AB2C10D19 |
-117.0 |
2.25 |
-9.22 |
1.02 |
0 |
|
|
290702 |
109817161 |
1 |
O3N4C23H30 |
A3B4C23D30 |
-58.01 |
5.35 |
-8.74 |
-0.03 |
0 |
|
|
290703 |
109817168 |
1 |
ISO4N5C17H34 |
ABC4D5E17F34 |
-186.33 |
7.75 |
-9.03 |
0.18 |
0 |
|
|
290704 |
109817172 |
1 |
ISO2N4C18H35 |
ABC2D4E18F35 |
-110.78 |
3.5 |
-9.12 |
0.12 |
0 |
|
|
290705 |
109817173 |
1 |
SO2N4C18H34 |
AB2C4D18E34 |
-102.58 |
4.8 |
-8.74 |
0.51 |
0 |
|
|
290706 |
109817177 |
1 |
ClFON4C19H28 |
ABCD4E19F28 |
-83.54 |
2.09 |
-9.1 |
-0.39 |
0 |
|
|
290707 |
109817197 |
2 |
ON2C10H19 |
AB2C10D19 |
-115.77 |
4.88 |
-8.94 |
0.94 |
0 |
|
|
290708 |
109817199 |
1 |
ON5C20H29 |
AB5C20D29 |
7.96 |
2.65 |
-8.13 |
0.42 |
0 |
|
|
290709 |
109817202 |
1 |
ION5C20H30 |
ABC5D20E30 |
2.83 |
6.39 |
-8.2 |
0.37 |
0 |
|
|
290710 |
109817204 |
1 |
IOSN4C16H27 |
ABCD4E16F27 |
-23.7 |
5.75 |
-8.93 |
0.04 |
0 |
|
|
290711 |
109817210 |
1 |
IO2N5C19H30 |
AB2C5D19E30 |
-61.44 |
3.97 |
-9.3 |
-0.19 |
0 |
|
|
290712 |
109817220 |
1 |
ION4C16H33 |
ABC4D16E33 |
-75.6 |
6.63 |
-9.05 |
0.59 |
0 |
|
|
290713 |
109817223 |
1 |
ON4C17H34 |
AB4C17D34 |
-76.3 |
2.94 |
-8.99 |
0.91 |
0 |
|
|
290714 |
109817224 |
1 |
ClFION4C18H25 |
ABCDE4F18G25 |
-49.42 |
3.59 |
-9.06 |
-0.49 |
0 |
|
|
290715 |
109821261 |
1 |
ION6C17H31 |
ABC6D17E31 |
-21.67 |
6.94 |
-9.08 |
0.42 |
0 |
|
|
290716 |
109827158 |
1 |
IO2S2N3C14H26 |
AB2C2D3E14F26 |
-74.12 |
5.33 |
-8.92 |
0.08 |
0 |
|
|
290717 |
109827544 |
1 |
BrISO3N4C17H28 |
ABCD3E4F17G28 |
-105.81 |
6.12 |
-9.52 |
-0.85 |
0 |
|
|
290718 |
109833429 |
1 |
SO2N6C17H24 |
AB2C6D17E24 |
44.76 |
9.7 |
-8.75 |
-0.81 |
0 |
|
|
290719 |
109834405 |
1 |
ISO2N4C22H35 |
ABC2D4E22F35 |
-42.04 |
2.08 |
-7.96 |
-0.04 |
0 |
|
|
290720 |
109835642 |
1 |
ISO2N5C23H36 |
ABC2D5E23F36 |
-58.42 |
5.96 |
-9.13 |
-0.46 |
0 |
|
|
290721 |
109837533 |
1 |
IN4O5C22H35 |
AB4C5D22E35 |
-208.91 |
5.19 |
-9.09 |
-0.44 |
0 |
|
|
290722 |
109839714 |
1 |
ON7C24H39 |
AB7C24D39 |
18.29 |
3.45 |
-8.73 |
-0.09 |
0 |
|
|
290723 |
109841152 |
1 |
N4C19H38 |
A4B19C38 |
-32.2 |
2.39 |
-8.57 |
1.68 |
0 |
|
|
290724 |
109841613 |
1 |
ION4C25H43 |
ABC4D25E43 |
-62.58 |
3.67 |
-8.89 |
0.34 |
0 |
|
|
290725 |
109844247 |
1 |
ClIOSN6C21H30 |
ABCDE6F21G30 |
14.84 |
4.78 |
-8.42 |
-0.65 |
0 |
|
|
290726 |
109850183 |
1 |
O2N4C23H36 |
A2B4C23D36 |
-68.64 |
3.43 |
-8.58 |
0.39 |
0 |
|
|
290727 |
109858708 |
1 |
IOSN7C19H32 |
ABCD7E19F32 |
29.62 |
7.14 |
-9.04 |
-0.42 |
0 |
|
|
290728 |
109863240 |
1 |
IOSN6C22H33 |
ABCD6E22F33 |
11.32 |
8.21 |
-8.33 |
0.03 |
0 |
|
|
290729 |
109875070 |
1 |
BrNSO3C12H16 |
ABCD3E12F16 |
-82.85 |
5.72 |
-9.82 |
-1.05 |
0 |
|
|
290730 |
109882834 |
1 |
NO3C14H27 |
AB3C14D27 |
-180.13 |
2.67 |
-8.89 |
0.94 |
0 |
|
|
290731 |
109883247 |
2 |
ON2C9H16 |
AB2C9D16 |
-100.35 |
6.4 |
-8.95 |
0.5 |
0 |
|
|
290732 |
109885085 |
1 |
N2O2F3C15H19 |
A2B2C3D15E19 |
-245.88 |
3.09 |
-8.92 |
0.01 |
0 |
|
|
290733 |
109885160 |
1 |
NOF4C14H17 |
ABC4D14E17 |
-244.45 |
4.69 |
-9.26 |
-0.19 |
0 |
|
|
290734 |
109885823 |
1 |
F2N3C18H19 |
A2B3C18D19 |
-22.52 |
2.68 |
-8.72 |
-0.16 |
0 |
|
|
290735 |
109885925 |
1 |
O2N3C15H27 |
A2B3C15D27 |
-89.45 |
2.33 |
-8.89 |
0.01 |
0 |
|
|
290736 |
109889267 |
1 |
SN2O3C13H22 |
AB2C3D13E22 |
-110.12 |
2.66 |
-8.8 |
0.19 |
0 |
|
|
290737 |
109890824 |
1 |
N5C22H25 |
A5B22C25 |
91.84 |
3.29 |
-8.64 |
0.22 |
0 |
|
|
290738 |
109890973 |
1 |
ClFION3C16H18 |
ABCDE3F16G18 |
-45.78 |
5.97 |
-8.85 |
-0.39 |
0 |
|
|
290739 |
109894540 |
3 |
NOC5H7 |
ABC5D7 |
-123.08 |
2.17 |
-8.98 |
-0.61 |
0 |
|
|
290740 |
109896267 |
1 |
BrFNOC13H17 |
ABCDE13F17 |
-87.45 |
2.37 |
-9.28 |
-0.51 |
0 |
|
|
290741 |
109904033 |
1 |
SN2O2C16H26 |
AB2C2D16E26 |
-103.94 |
1.74 |
-8.97 |
-0.36 |
0 |
|
|
290742 |
109916936 |
1 |
FN2O3C17H25 |
AB2C3D17E25 |
-179.22 |
5.48 |
-8.84 |
0.02 |
0 |
|
|
290743 |
109918761 |
1 |
NO4C19H19 |
AB4C19D19 |
-97.34 |
4.54 |
-8.93 |
-0.97 |
0 |
|
|
290744 |
109936069 |
1 |
BrNO3C15H24 |
ABC3D15E24 |
-119.8 |
2.87 |
-8.81 |
-0.55 |
0 |
|
|
290745 |
109967364 |
1 |
NF3O4C14H18 |
AB3C4D14E18 |
-308.1 |
3.33 |
-9.57 |
-0.75 |
0 |
|
|
290746 |
109968113 |
1 |
N2O2F3C14H19 |
A2B2C3D14E19 |
-226.11 |
5.53 |
-9.35 |
-0.16 |
0 |
|
|
290747 |
109968828 |
1 |
ClN2O2C18H21 |
AB2C2D18E21 |
-61.5 |
3.85 |
-8.92 |
-0.36 |
0 |
|
|
290748 |
109970547 |
1 |
NSO3C13H21 |
ABC3D13E21 |
-128.65 |
3.08 |
-9.33 |
0.25 |
0 |
|
|
290749 |
109979047 |
2 |
NOC9H14 |
ABC9D14 |
-107.07 |
2.86 |
-9.29 |
0.2 |
0 |
|
|
290750 |
109989340 |
1 |
F2O2N3C16H17 |
A2B2C3D16E17 |
-141.75 |
3.09 |
-10.12 |
-0.91 |
0 |
|
|
290751 |
110001576 |
1 |
SN2O2C15H22 |
AB2C2D15E22 |
-72.2 |
6.74 |
-8.43 |
-0.32 |
0 |
|
|
290752 |
110005154 |
1 |
OS2N3C13H15 |
AB2C3D13E15 |
48.53 |
4.61 |
-8.59 |
-0.94 |
0 |
|
|
290753 |
110007721 |
1 |
NSO3C12H17 |
ABC3D12E17 |
-83.53 |
2.32 |
-9.39 |
-0.76 |
0 |
|
|
290754 |
110009933 |
1 |
NO3C17H25 |
AB3C17D25 |
-125.89 |
4.48 |
-9.16 |
0.16 |
0 |
|
|
290755 |
110018435 |
1 |
FION5C19H27 |
ABCD5E19F27 |
-30.25 |
8.3 |
-8.18 |
0.11 |
0 |
|
|
290756 |
110021486 |
2 |
NOC8H13 |
ABC8D13 |
-99.87 |
5.03 |
-9.81 |
-0.27 |
0 |
|
|
290757 |
110067583 |
1 |
O3N5C29H37 |
A3B5C29D37 |
-59.21 |
8.19 |
-9.11 |
-0.5 |
0 |
|
|
290758 |
110067587 |
1 |
O3N5C31H35 |
A3B5C31D35 |
-42.62 |
6.81 |
-8.98 |
-0.39 |
0 |
|
|
290759 |
110103134 |
2 |
ON2C8H12 |
AB2C8D12 |
-66.89 |
3.11 |
-9.19 |
-0.53 |
0 |
|
|
290760 |
110207745 |
1 |
N3O8H25C28 |
A3B8C25D28 |
-258.31 |
4.06 |
-9.22 |
-1.13 |
0 |
|
|
290761 |
110250061 |
1 |
N6C19H22 |
A6B19C22 |
112.45 |
2.21 |
-8.91 |
-1.13 |
0 |
|
|
290762 |
110376844 |
1 |
N3O4H19C20 |
A3B4C19D20 |
-72.34 |
8.31 |
-8.76 |
-0.72 |
0 |
|
|
290763 |
110472983 |
1 |
ClON3H10C11 |
ABC3D10E11 |
12.9 |
1.99 |
-9.02 |
-0.87 |
0 |
|
|
290764 |
110473190 |
1 |
NO3H15C16 |
AB3C15D16 |
-80.31 |
1.53 |
-9.26 |
-0.76 |
0 |
|
|
290765 |
110474414 |
1 |
ON5H11C13 |
AB5C11D13 |
67.87 |
8.99 |
-8.72 |
-0.76 |
0 |
|
|
290766 |
110475065 |
1 |
OSN5H9C11 |
ABC5D9E11 |
71.45 |
7.91 |
-9.34 |
-1.55 |
0 |
|
|
290767 |
110489960 |
1 |
O2N3C15H17 |
A2B3C15D17 |
-25.92 |
5.23 |
-9.03 |
-1.01 |
0 |
|
|
290768 |
110503652 |
1 |
SN3O4C23H27 |
AB3C4D23E27 |
-140.96 |
8.09 |
-8.74 |
-1.16 |
0 |
|
|
290769 |
110508837 |
1 |
ClO2N3C16H16 |
AB2C3D16E16 |
-15.88 |
5.45 |
-8.67 |
-0.7 |
0 |
|
|
290770 |
110522911 |
1 |
SO2N4C19H20 |
AB2C4D19E20 |
7.53 |
4.06 |
-8.73 |
-1.34 |
0 |
|
|
290771 |
110525256 |
1 |
ClSN3O3H16C17 |
ABC3D3E16F17 |
9.8 |
3.42 |
-8.9 |
-1.72 |
0 |
|
|
290772 |
110525995 |
1 |
O3N4H14C17 |
A3B4C14D17 |
-21.59 |
5.74 |
-8.26 |
-1.66 |
0 |
|
|
290773 |
110606523 |
1 |
FO2N3C18H20 |
AB2C3D18E20 |
-96.79 |
3.48 |
-9.0 |
-0.25 |
0 |
|
|
290774 |
110607721 |
1 |
NO3C19H25 |
AB3C19D25 |
-98.84 |
3.68 |
-9.08 |
-0.58 |
0 |
|
|
290775 |
110650797 |
1 |
O2N3C24H25 |
A2B3C24D25 |
-25.87 |
4.36 |
-7.77 |
-1.04 |
0 |
|
|
290776 |
110713058 |
1 |
NSO2C18H19 |
ABC2D18E19 |
-40.79 |
2.24 |
-8.44 |
-0.08 |
0 |
|
|
290777 |
110722933 |
1 |
NSO4C14H19 |
ABC4D14E19 |
-159.45 |
8.72 |
-9.41 |
-0.53 |
0 |
|
|
290778 |
110723060 |
1 |
SN2O3C14H16 |
AB2C3D14E16 |
-75.63 |
7.75 |
-8.9 |
-0.61 |
0 |
|
|
290779 |
110723063 |
1 |
ON2C10H12 |
AB2C10D12 |
5.26 |
4.09 |
-9.23 |
-0.36 |
0 |
|
|
290780 |
110723064 |
1 |
ON2C11H14 |
AB2C11D14 |
1.9 |
4.06 |
-9.24 |
-0.39 |
0 |
|
|
290781 |
110723065 |
1 |
ON2C12H16 |
AB2C12D16 |
-3.55 |
3.85 |
-9.19 |
-0.34 |
0 |
|
|
290782 |
110723066 |
1 |
ON2C12H16 |
AB2C12D16 |
-1.36 |
3.84 |
-9.08 |
-0.3 |
0 |
|
|
290783 |
110723069 |
1 |
ON2C13H18 |
AB2C13D18 |
-9.43 |
3.31 |
-9.11 |
-0.27 |
0 |
|
|
290784 |
110723070 |
1 |
ON2C15H20 |
AB2C15D20 |
-8.29 |
3.71 |
-9.21 |
-0.34 |
0 |
|
|
290785 |
110723071 |
1 |
N2O2C13H16 |
A2B2C13D16 |
-30.74 |
3.27 |
-9.22 |
-0.25 |
0 |
|
|
290786 |
110723075 |
1 |
ON2C14H20 |
AB2C14D20 |
-8.7 |
3.09 |
-9.45 |
-0.18 |
0 |
|
|
290787 |
110723077 |
1 |
OSN2H12C13 |
ABC2D12E13 |
49.7 |
5.17 |
-9.23 |
-0.58 |
0 |
|
|
290788 |
110723078 |
1 |
ON2C16H16 |
AB2C16D16 |
31.77 |
2.24 |
-9.09 |
-0.3 |
0 |
|
|
290789 |
110848810 |
1 |
FON2C15H17 |
ABC2D15E17 |
-68.54 |
4.46 |
-8.64 |
-0.24 |
0 |
|
|
290790 |
110910307 |
1 |
N2O2C15H24 |
A2B2C15D24 |
-105.99 |
3.78 |
-9.12 |
0.32 |
0 |
|
|
290791 |
110932486 |
1 |
FO2N4C15H15 |
AB2C4D15E15 |
-62.35 |
4.76 |
-9.08 |
-1.0 |
0 |
|
|
290792 |
110937540 |
2 |
ON2C8H10 |
AB2C8D10 |
-14.7 |
6.24 |
-9.38 |
-0.26 |
0 |
|
|
290793 |
111123291 |
1 |
ON3C17H23 |
AB3C17D23 |
-7.38 |
7.31 |
-8.55 |
0.26 |
0 |
|
|
290794 |
111123297 |
1 |
ClN2O2C16H21 |
AB2C2D16E21 |
-64.99 |
5.74 |
-8.79 |
-0.31 |
0 |
|
|
290795 |
111123304 |
1 |
FNO3C15H22 |
ABC3D15E22 |
-176.04 |
1.51 |
-9.01 |
-0.19 |
0 |
|
|
290796 |
111123312 |
1 |
NO3C17H27 |
AB3C17D27 |
-127.15 |
2.49 |
-8.77 |
0.34 |
0 |
|
|
290797 |
111123318 |
1 |
NO3C20H35 |
AB3C20D35 |
-133.33 |
2.54 |
-8.82 |
1.02 |
0 |
|
|
290798 |
111123325 |
1 |
N2O3C14H28 |
A2B3C14D28 |
-143.05 |
1.16 |
-8.86 |
1.97 |
0 |
|
|
290799 |
111123328 |
1 |
NO3C20H31 |
AB3C20D31 |
-132.2 |
2.54 |
-8.85 |
0.22 |
0 |