List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
22757 |
598552 |
1 |
Cl2O2N4C9H14 |
A2B2C4D9E14 |
-56.62 |
3.3 |
-9.52 |
-0.27 |
0 |
|
|
22758 |
598561 |
1 |
N2O4H14C15 |
A2B4C14D15 |
-101.76 |
2.72 |
-9.8 |
-1.59 |
0 |
|
|
22759 |
598569 |
2 |
NOH8C11 |
ABC8D11 |
39.22 |
3.1 |
-8.52 |
-1.22 |
0 |
|
|
22760 |
598611 |
1 |
OSiC11H24 |
ABC11D24 |
-129.91 |
1.62 |
-8.94 |
1.4 |
0 |
|
|
22761 |
598614 |
2 |
ON2C4H9 |
AB2C4D9 |
-80.22 |
3.81 |
-10.17 |
0.85 |
0 |
|
|
22762 |
598618 |
2 |
O3C4H5 |
A3B4C5 |
-228.87 |
2.33 |
-11.17 |
-1.64 |
0 |
|
|
22763 |
598620 |
1 |
N2O5H10C12 |
A2B5C10D12 |
-76.0 |
6.14 |
-10.1 |
-1.54 |
0 |
|
|
22764 |
598622 |
1 |
OPS3C13H13 |
ABC3D13E13 |
-49.75 |
6.04 |
-8.39 |
-0.67 |
0 |
|
|
22765 |
598641 |
1 |
NSO3C11H19 |
ABC3D11E19 |
-139.18 |
3.25 |
-8.7 |
0.34 |
0 |
|
|
22766 |
598646 |
1 |
OSiC10H22 |
ABC10D22 |
-109.59 |
1.92 |
-9.49 |
1.0 |
0 |
|
|
22767 |
598656 |
1 |
OSiC18H38 |
ABC18D38 |
-166.34 |
1.82 |
-9.13 |
1.39 |
0 |
|
|
22768 |
598675 |
1 |
FNO2C8H10 |
ABC2D8E10 |
-105.35 |
2.61 |
-8.75 |
-0.17 |
0 |
|
|
22769 |
598677 |
1 |
FNO3C9H12 |
ABC3D9E12 |
-154.06 |
3.02 |
-8.84 |
-0.27 |
0 |
|
|
22770 |
598678 |
1 |
FOSN2C11H15 |
ABCD2E11F15 |
-68.72 |
2.65 |
-8.81 |
-0.34 |
0 |
|
|
22771 |
598683 |
1 |
ClOSiC10H21 |
ABCD10E21 |
-136.08 |
2.21 |
-9.17 |
0.92 |
0 |
|
|
22772 |
598684 |
1 |
SiO2C10H20 |
AB2C10D20 |
-165.68 |
3.01 |
-9.28 |
0.67 |
0 |
|
|
22773 |
598685 |
3 |
NOC7H9 |
ABC7D9 |
-95.39 |
3.32 |
-8.84 |
-0.7 |
0 |
|
|
22774 |
598686 |
1 |
OSiC11H24 |
ABC11D24 |
-134.53 |
1.63 |
-8.91 |
1.42 |
0 |
|
|
22775 |
598687 |
1 |
ClSiO2C9H17 |
ABC2D9E17 |
-165.85 |
3.41 |
-9.46 |
0.47 |
0 |
|
|
22776 |
598688 |
1 |
OSiC11H24 |
ABC11D24 |
-129.79 |
1.92 |
-9.01 |
1.31 |
0 |
|
|
22777 |
598689 |
1 |
OC13H14 |
AB13C14 |
33.56 |
2.23 |
-8.99 |
-0.06 |
0 |
|
|
22778 |
598693 |
1 |
ClNSO3H16C18 |
ABCD3E16F18 |
-67.55 |
8.65 |
-8.84 |
-1.03 |
0 |
|
|
22779 |
598695 |
1 |
N3O3H13C19 |
A3B3C13D19 |
6.91 |
5.83 |
-8.69 |
-1.25 |
0 |
|
|
22780 |
598697 |
1 |
BrOSH9C11 |
ABCD9E11 |
-7.79 |
0.92 |
-8.8 |
-0.8 |
0 |
|
|
22781 |
598698 |
1 |
O5C16H18 |
A5B16C18 |
-153.73 |
1.33 |
-9.14 |
-1.4 |
0 |
|
|
22782 |
598699 |
2 |
NO2C10H12 |
AB2C10D12 |
-131.27 |
6.08 |
-8.73 |
-0.83 |
0 |
|
|
22783 |
598700 |
2 |
O2H8C9 |
A2B8C9 |
43.8 |
5.33 |
-9.75 |
-0.61 |
0 |
|
|
22784 |
598708 |
1 |
F3N5H6C9 |
A3B5C6D9 |
-44.37 |
6.39 |
-9.58 |
-1.73 |
0 |
|
|
22785 |
598709 |
2 |
NC10H14 |
AB10C14 |
43.68 |
3.63 |
-7.93 |
0.18 |
0 |
|
|
22786 |
598711 |
1 |
OSH12C13 |
ABC12D13 |
12.39 |
5.32 |
-8.69 |
-1.0 |
0 |
|
|
22787 |
598712 |
1 |
O3C14H14 |
A3B14C14 |
-4.71 |
4.35 |
-9.41 |
-0.7 |
0 |
|
|
22788 |
598733 |
2 |
NC6H7 |
AB6C7 |
57.43 |
8.27 |
-9.68 |
-1.09 |
0 |
|
|
22789 |
598735 |
1 |
ON2C14H16 |
AB2C14D16 |
-12.94 |
2.18 |
-8.81 |
-0.68 |
0 |
|
|
22790 |
598737 |
2 |
NC6H7 |
AB6C7 |
54.18 |
6.46 |
-9.63 |
-0.85 |
0 |
|
|
22791 |
598742 |
1 |
SO4N5C9H11 |
AB4C5D9E11 |
-60.7 |
3.49 |
-10.21 |
-1.42 |
0 |
|
|
22792 |
598743 |
1 |
ClON2C21H21 |
ABC2D21E21 |
-7.4 |
3.56 |
-8.62 |
-0.51 |
0 |
|
|
22793 |
598744 |
1 |
ClSO2N4C5H5 |
ABC2D4E5F5 |
-33.05 |
3.9 |
-9.37 |
-1.39 |
0 |
|
|
22794 |
598745 |
1 |
ON3H5C9 |
AB3C5D9 |
90.0 |
5.82 |
-9.9 |
-1.86 |
0 |
|
|
22795 |
598746 |
1 |
ON3H9C11 |
AB3C9D11 |
47.61 |
6.53 |
-9.67 |
-1.36 |
0 |
|
|
22796 |
598747 |
1 |
N3H9C10 |
A3B9C10 |
60.24 |
2.87 |
-9.29 |
-0.78 |
0 |
|
|
22797 |
598748 |
1 |
SN3C7H13 |
AB3C7D13 |
25.49 |
5.63 |
-8.92 |
-0.26 |
0 |
|
|
22798 |
598749 |
1 |
FNO2C8H10 |
ABC2D8E10 |
-98.43 |
4.16 |
-8.08 |
-0.03 |
0 |
|
|
22799 |
598752 |
1 |
N3H19C20 |
A3B19C20 |
74.84 |
1.26 |
-8.36 |
-0.51 |
0 |
|
|
22800 |
598754 |
1 |
N3C14H17 |
A3B14C17 |
46.1 |
2.96 |
-8.25 |
-0.29 |
0 |
|
|
22801 |
598755 |
1 |
SN2O2H18C21 |
AB2C2D18E21 |
4.98 |
1.53 |
-8.65 |
-0.7 |
0 |
|
|
22802 |
598763 |
1 |
BrIO3H14C16 |
ABC3D14E16 |
-40.56 |
1.65 |
-9.02 |
-1.12 |
0 |
|
|
22803 |
598766 |
1 |
Br2N3O4H9C12 |
A2B3C4D9E12 |
-64.3 |
6.29 |
-10.06 |
-2.12 |
0 |
|
|
22804 |
598767 |
1 |
BrFSN4H10C14 |
ABCD4E10F14 |
89.98 |
5.19 |
-9.38 |
-1.21 |
0 |
|
|
22805 |
598770 |
1 |
BrNC13H20 |
ABC13D20 |
-2.01 |
3.46 |
-8.74 |
0.04 |
0 |
|
|
22806 |
598772 |
1 |
SN2O2C18H24 |
AB2C2D18E24 |
-56.18 |
6.26 |
-8.82 |
-0.89 |
0 |
|
|
22807 |
598774 |
1 |
NC13H16 |
AB13C16 |
71.8 |
1.86 |
0.0 |
0.0 |
1 |
|
|
22808 |
598775 |
1 |
N3H9C10 |
A3B9C10 |
72.84 |
2.62 |
-8.62 |
-0.61 |
0 |
|
|
22809 |
598776 |
1 |
N3H9C10 |
A3B9C10 |
73.99 |
4.7 |
-9.08 |
-0.68 |
0 |
|
|
22810 |
598777 |
1 |
N3H9C10 |
A3B9C10 |
64.89 |
1.03 |
-9.22 |
-0.56 |
0 |
|
|
22811 |
598778 |
1 |
BrO2H7C11 |
AB2C7D11 |
-29.64 |
3.71 |
-9.22 |
-1.35 |
0 |
|
|
22812 |
598779 |
1 |
NOH9C11 |
ABC9D11 |
10.87 |
7.68 |
-9.13 |
-0.59 |
0 |
|
|
22813 |
598780 |
1 |
NOH9C11 |
ABC9D11 |
19.09 |
6.14 |
-9.14 |
-0.52 |
0 |
|
|
22814 |
598781 |
1 |
NOH9C11 |
ABC9D11 |
26.99 |
2.59 |
-9.1 |
-1.1 |
0 |
|
|
22815 |
598782 |
1 |
NOH9C11 |
ABC9D11 |
17.91 |
2.68 |
-8.99 |
-0.64 |
0 |
|
|
22816 |
598787 |
1 |
NC12H13 |
AB12C13 |
53.27 |
1.67 |
-9.39 |
-0.36 |
0 |
|
|
22817 |
598789 |
2 |
NSO2C8H9 |
ABC2D8E9 |
-114.58 |
6.92 |
-9.17 |
-1.25 |
0 |
|
|
22818 |
598790 |
1 |
SN2O2C19H20 |
AB2C2D19E20 |
-8.28 |
6.83 |
-8.82 |
-0.94 |
0 |
|
|
22819 |
598791 |
1 |
SN2O4C18H24 |
AB2C4D18E24 |
-141.68 |
6.72 |
-9.28 |
-1.27 |
0 |
|
|
22820 |
598794 |
1 |
N3H9C10 |
A3B9C10 |
78.26 |
7.6 |
-8.19 |
-0.52 |
0 |
|
|
22821 |
598795 |
1 |
NC12H13 |
AB12C13 |
28.68 |
1.74 |
-8.16 |
0.19 |
0 |
|
|
22822 |
598864 |
2 |
OH5C6 |
AB5C6 |
-47.35 |
4.24 |
-9.03 |
-0.97 |
0 |
|
|
22823 |
598931 |
1 |
SN2O4C17H22 |
AB2C4D17E22 |
-137.16 |
11.33 |
-9.19 |
-1.36 |
0 |
|
|
22824 |
598949 |
1 |
NO2C21H25 |
AB2C21D25 |
-47.77 |
2.9 |
-8.66 |
-0.52 |
0 |
|
|
22825 |
598953 |
1 |
ClSO2N3H8C10 |
ABC2D3E8F10 |
41.5 |
3.95 |
-8.88 |
-1.77 |
0 |
|
|
22826 |
598954 |
1 |
O6C13H22 |
A6B13C22 |
-273.7 |
2.3 |
-9.55 |
0.84 |
0 |
|
|
22827 |
598957 |
1 |
OC12H12 |
AB12C12 |
-5.42 |
0.82 |
-8.61 |
0.23 |
0 |
|
|
22828 |
598967 |
1 |
BrSN2O3C12H17 |
ABC2D3E12F17 |
-119.91 |
6.61 |
-9.63 |
-0.75 |
0 |
|
|
22829 |
598968 |
2 |
PF2N3C8H8 |
AB2C3D8E8 |
-240.11 |
2.34 |
-8.85 |
-0.44 |
0 |
|
|
22830 |
599038 |
1 |
ON5C11H11 |
AB5C11D11 |
98.01 |
3.74 |
-9.03 |
-1.09 |
0 |
|
|
22831 |
599048 |
1 |
N2O3H10C11 |
A2B3C10D11 |
-61.47 |
7.61 |
-9.1 |
-1.86 |
0 |
|
|
22832 |
599050 |
2 |
OC7H7 |
AB7C7 |
-60.06 |
2.14 |
-9.11 |
-0.88 |
0 |
|
|
22833 |
599052 |
1 |
OPSC7H9 |
ABCD7E9 |
-79.81 |
4.33 |
-9.11 |
-0.35 |
0 |
|
|
22834 |
599053 |
1 |
OPSC11H17 |
ABCD11E17 |
-94.76 |
4.63 |
-8.75 |
-0.22 |
0 |
|
|
22835 |
599054 |
1 |
OC12H12 |
AB12C12 |
-6.57 |
3.01 |
-9.51 |
-0.75 |
0 |
|
|
22836 |
599055 |
1 |
OC12H12 |
AB12C12 |
-8.18 |
4.65 |
-9.52 |
-0.8 |
0 |
|
|
22837 |
599056 |
1 |
OC12H12 |
AB12C12 |
-22.84 |
0.54 |
-8.29 |
-0.22 |
0 |
|
|
22838 |
599058 |
1 |
OC12H12 |
AB12C12 |
4.85 |
1.91 |
-8.6 |
-0.39 |
0 |
|
|
22839 |
599059 |
1 |
ClON3C9H14 |
ABC3D9E14 |
-39.11 |
3.36 |
-8.98 |
-0.39 |
0 |
|
|
22840 |
599060 |
1 |
NO3C21H33 |
AB3C21D33 |
-146.03 |
1.15 |
-8.82 |
0.13 |
0 |
|
|
22841 |
599062 |
1 |
NO5C17H21 |
AB5C17D21 |
-180.28 |
4.87 |
-9.28 |
-0.26 |
0 |
|
|
22842 |
599063 |
2 |
OC7H8 |
AB7C8 |
-56.11 |
1.54 |
-9.15 |
0.43 |
0 |
|
|
22843 |
599064 |
1 |
BrO2N3H10C13 |
AB2C3D10E13 |
79.92 |
6.75 |
-8.89 |
-1.62 |
0 |
|
|
22844 |
599065 |
1 |
ON2H8C10 |
AB2C8D10 |
51.43 |
3.59 |
-9.65 |
-0.8 |
0 |
|
|
22845 |
599066 |
1 |
N2C11H12 |
A2B11C12 |
40.53 |
1.19 |
-9.44 |
-0.75 |
0 |
|
|
22846 |
599081 |
1 |
SN3O3C17H25 |
AB3C3D17E25 |
-63.62 |
5.91 |
-8.29 |
-0.88 |
0 |
|
|
22847 |
599096 |
1 |
NO2C18H25 |
AB2C18D25 |
-55.97 |
4.42 |
-8.98 |
-0.75 |
0 |
|
|
22848 |
599106 |
1 |
BrON3C7H10 |
ABC3D7E10 |
-31.18 |
5.44 |
-9.06 |
0.24 |
0 |
|
|
22849 |
599107 |
1 |
OCl2H10C12 |
AB2C10D12 |
3.92 |
3.92 |
-9.72 |
-0.6 |
0 |
|
|
22850 |
599108 |
1 |
OSCl2N3H5C11 |
ABC2D3E5F11 |
37.68 |
9.1 |
-10.27 |
-1.54 |
0 |
|
|
22851 |
599182 |
1 |
O2F3C16H21 |
A2B3C16D21 |
-262.43 |
3.5 |
-10.55 |
-1.25 |
0 |
|
|
22852 |
599201 |
1 |
OC14H22 |
AB14C22 |
-75.24 |
2.15 |
-9.07 |
0.45 |
0 |
|
|
22853 |
599202 |
1 |
NOC11H11 |
ABC11D11 |
4.06 |
1.48 |
-9.2 |
-0.55 |
0 |
|
|
22854 |
599206 |
1 |
O2F3C21H31 |
A2B3C21D31 |
-284.21 |
1.51 |
-10.67 |
-1.14 |
0 |
|
|
22855 |
599207 |
1 |
O2F3C20H29 |
A2B3C20D29 |
-275.47 |
2.17 |
-10.57 |
-1.16 |
0 |
|
|
22856 |
599217 |
1 |
O2F3C12H13 |
A2B3C12D13 |
-241.02 |
3.11 |
-10.59 |
-1.3 |
0 |