List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
281050 |
103852605 |
1 |
ClO2N3C16H24 |
AB2C3D16E24 |
-104.35 |
7.37 |
-8.57 |
-0.26 |
0 |
|
|
281051 |
103852606 |
1 |
ClO2N3C16H24 |
AB2C3D16E24 |
-109.21 |
4.91 |
-8.66 |
-0.33 |
0 |
|
|
281052 |
103852608 |
1 |
ClO2N3C17H26 |
AB2C3D17E26 |
-110.71 |
5.03 |
-8.7 |
-0.36 |
0 |
|
|
281053 |
103852618 |
1 |
BrNOC11H14 |
ABCD11E14 |
-45.87 |
4.25 |
-9.51 |
-0.51 |
0 |
|
|
281054 |
103852627 |
1 |
BrNOH16C17 |
ABCD16E17 |
-3.62 |
5.34 |
-8.55 |
-0.51 |
0 |
|
|
281055 |
103852638 |
1 |
NO4C13H23 |
AB4C13D23 |
-199.0 |
8.05 |
-10.36 |
0.51 |
0 |
|
|
281056 |
103852645 |
1 |
BrNOC16H16 |
ABCD16E16 |
-2.18 |
4.57 |
-9.25 |
-0.45 |
0 |
|
|
281057 |
103852647 |
1 |
BrNO2C13H16 |
ABC2D13E16 |
-79.06 |
5.47 |
-9.41 |
-0.63 |
0 |
|
|
281058 |
103852648 |
1 |
BrON2C15H21 |
ABC2D15E21 |
-34.05 |
3.14 |
-8.72 |
-0.44 |
0 |
|
|
281059 |
103852658 |
1 |
BrNOC16H16 |
ABCD16E16 |
-20.66 |
3.32 |
-8.41 |
-0.67 |
0 |
|
|
281060 |
103852665 |
1 |
BrNO2H14C15 |
ABC2D14E15 |
-41.41 |
5.44 |
-8.24 |
-0.7 |
0 |
|
|
281061 |
103852670 |
1 |
BrINOH11C14 |
ABCDE11F14 |
14.14 |
3.36 |
-8.89 |
-0.96 |
0 |
|
|
281062 |
103852690 |
1 |
BrON2H13C14 |
ABC2D13E14 |
5.37 |
4.15 |
-9.62 |
-0.7 |
0 |
|
|
281063 |
103852700 |
1 |
BrNOC13H18 |
ABCD13E18 |
-52.64 |
4.26 |
-9.38 |
-0.51 |
0 |
|
|
281064 |
103852706 |
1 |
BrNO3C14H20 |
ABC3D14E20 |
-112.79 |
3.52 |
-9.1 |
-0.56 |
0 |
|
|
281065 |
103852709 |
1 |
BrN2O3C15H19 |
AB2C3D15E19 |
-119.77 |
2.41 |
-9.33 |
-0.57 |
0 |
|
|
281066 |
103852711 |
1 |
BrNOC18H20 |
ABCD18E20 |
-22.61 |
4.4 |
-9.09 |
-0.58 |
0 |
|
|
281067 |
103852720 |
1 |
BrNO2C16H16 |
ABC2D16E16 |
-45.78 |
5.05 |
-8.85 |
-0.54 |
0 |
|
|
281068 |
103852727 |
1 |
BrNO2C16H16 |
ABC2D16E16 |
-50.01 |
4.18 |
-8.22 |
-0.59 |
0 |
|
|
281069 |
103852728 |
1 |
BrNO3C16H20 |
ABC3D16E20 |
-131.12 |
5.56 |
-9.21 |
-0.46 |
0 |
|
|
281070 |
103852731 |
1 |
BrFNOH13C15 |
ABCDE13F15 |
-59.03 |
5.65 |
-8.74 |
-0.81 |
0 |
|
|
281071 |
103852733 |
1 |
BrNO2C14H18 |
ABC2D14E18 |
-96.71 |
4.04 |
-9.56 |
-0.61 |
0 |
|
|
281072 |
103852764 |
1 |
BrNOC15H20 |
ABCD15E20 |
-57.16 |
4.26 |
-9.38 |
-0.49 |
0 |
|
|
281073 |
103852779 |
1 |
BrNO2C17H18 |
ABC2D17E18 |
-38.96 |
6.03 |
-8.78 |
-0.36 |
0 |
|
|
281074 |
103852780 |
1 |
BrNO2C17H18 |
ABC2D17E18 |
-42.54 |
5.22 |
-8.98 |
-0.46 |
0 |
|
|
281075 |
103852792 |
1 |
ON2F3C14H15 |
AB2C3D14E15 |
-171.87 |
3.07 |
-9.59 |
-0.15 |
0 |
|
|
281076 |
103852794 |
1 |
BrON3C16H20 |
ABC3D16E20 |
-9.3 |
5.05 |
-9.08 |
-0.72 |
0 |
|
|
281077 |
103852799 |
1 |
BrFNOH15C16 |
ABCDE15F16 |
-49.81 |
4.07 |
-9.37 |
-0.49 |
0 |
|
|
281078 |
103852803 |
1 |
BrNO3C15H20 |
ABC3D15E20 |
-138.0 |
2.39 |
-9.62 |
-0.62 |
0 |
|
|
281079 |
103852805 |
1 |
ON3C10H21 |
AB3C10D21 |
-24.54 |
2.13 |
-8.96 |
1.0 |
0 |
|
|
281080 |
103852820 |
1 |
NOC15H23 |
ABC15D23 |
-18.89 |
0.64 |
-8.88 |
0.32 |
0 |
|
|
281081 |
103852821 |
1 |
NO2C15H23 |
AB2C15D23 |
-63.62 |
2.44 |
-9.31 |
0.37 |
0 |
|
|
281082 |
103852828 |
1 |
NF2O2C15H21 |
AB2C2D15E21 |
-163.04 |
4.21 |
-9.15 |
-0.1 |
0 |
|
|
281083 |
103852835 |
1 |
N3O3C11H21 |
A3B3C11D21 |
-131.51 |
3.22 |
-9.75 |
0.33 |
0 |
|
|
281084 |
103852836 |
1 |
N2O2C15H28 |
A2B2C15D28 |
-96.22 |
4.32 |
-9.16 |
1.09 |
0 |
|
|
281085 |
103852848 |
1 |
N3O3C10H19 |
A3B3C10D19 |
-131.48 |
3.95 |
-9.81 |
0.22 |
0 |
|
|
281086 |
103852851 |
1 |
N2O3C14H20 |
A2B3C14D20 |
-18.88 |
5.21 |
-9.16 |
-1.29 |
0 |
|
|
281087 |
103852854 |
1 |
ClNOC14H20 |
ABCD14E20 |
-25.13 |
2.26 |
-9.07 |
-0.12 |
0 |
|
|
281088 |
103852859 |
2 |
NOC6H12 |
ABC6D12 |
-95.21 |
4.66 |
-9.43 |
1.04 |
0 |
|
|
281089 |
103852875 |
1 |
BrNOC15H20 |
ABCD15E20 |
-12.73 |
2.07 |
-9.22 |
-0.17 |
0 |
|
|
281090 |
103852894 |
1 |
BrNO2C17H18 |
ABC2D17E18 |
-39.5 |
4.66 |
-9.38 |
-0.65 |
0 |
|
|
281091 |
103852920 |
1 |
BrN2O2C13H17 |
AB2C2D13E17 |
-87.35 |
1.76 |
-9.5 |
-0.53 |
0 |
|
|
281092 |
103852921 |
1 |
BrNOC13H16 |
ABCD13E16 |
-23.73 |
4.02 |
-9.51 |
-0.52 |
0 |
|
|
281093 |
103852926 |
1 |
BrON2H13C16 |
ABC2D13E16 |
23.45 |
7.54 |
-8.89 |
-0.86 |
0 |
|
|
281094 |
103852936 |
1 |
BrON3H12C15 |
ABC3D12E15 |
49.21 |
4.54 |
-8.41 |
-0.76 |
0 |
|
|
281095 |
103852949 |
1 |
BrNO2H14C15 |
ABC2D14E15 |
-5.7 |
4.36 |
-9.29 |
-0.77 |
0 |
|
|
281096 |
103852952 |
1 |
BrN2O2C12H15 |
AB2C2D12E15 |
-82.24 |
4.86 |
-9.64 |
-0.83 |
0 |
|
|
281097 |
103852953 |
1 |
BrN2O2C13H17 |
AB2C2D13E17 |
-86.92 |
4.27 |
-9.6 |
-0.8 |
0 |
|
|
281098 |
103904167 |
1 |
NO2C17H23 |
AB2C17D23 |
-28.81 |
2.03 |
-8.56 |
0.21 |
0 |
|
|
281099 |
103905689 |
1 |
NO2C13H23 |
AB2C13D23 |
-58.59 |
3.35 |
-9.23 |
1.86 |
0 |