List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
387746 |
134986692 |
1 |
NOF3H8C13 |
ABC3D8E13 |
-135.49 |
4.79 |
-9.52 |
-1.2 |
0 |
|
|
387747 |
134986697 |
1 |
O4C13H14 |
A4B13C14 |
-146.96 |
6.68 |
-9.51 |
-0.7 |
0 |
|
|
387748 |
134986699 |
1 |
O2C15H30 |
A2B15C30 |
-148.39 |
2.52 |
-9.74 |
2.13 |
0 |
|
|
387749 |
134986719 |
1 |
O3C13H18 |
A3B13C18 |
-98.23 |
3.84 |
-9.47 |
0.1 |
0 |
|
|
387750 |
134986722 |
1 |
BrO3C9H13 |
AB3C9D13 |
-117.62 |
1.46 |
-10.47 |
-0.82 |
0 |
|
|
387751 |
134986726 |
1 |
ClSiO2C12H23 |
ABC2D12E23 |
-164.36 |
3.17 |
-9.57 |
0.12 |
0 |
|
|
387752 |
134986727 |
1 |
NOC14H27 |
ABC14D27 |
-62.5 |
4.21 |
-8.75 |
0.85 |
0 |
|
|
387753 |
134986738 |
1 |
ClNO2C12H18 |
ABC2D12E18 |
-124.26 |
2.52 |
-9.74 |
0.13 |
0 |
|
|
387754 |
134986742 |
1 |
O3C12H14 |
A3B12C14 |
-49.31 |
2.61 |
-9.26 |
-0.15 |
0 |
|
|
387755 |
134986745 |
1 |
SiO2C15H32 |
AB2C15D32 |
-180.35 |
0.84 |
-8.73 |
0.82 |
0 |
|
|
387756 |
134986746 |
1 |
N4O5C9H18 |
A4B5C9D18 |
-117.65 |
2.68 |
-9.28 |
-0.41 |
0 |
|
|
387757 |
134986747 |
1 |
O3H10C13 |
A3B10C13 |
14.16 |
4.88 |
-8.98 |
-0.93 |
0 |
|
|
387758 |
134986755 |
1 |
SSiN2O2C12H22 |
ABC2D2E12F22 |
-80.04 |
8.25 |
-8.97 |
-0.7 |
0 |
|
|
387759 |
134986760 |
2 |
NOC6H7 |
ABC6D7 |
-16.44 |
3.64 |
-9.93 |
-0.78 |
1 |
|
|
387760 |
134986761 |
1 |
N2O2C12H15 |
A2B2C12D15 |
-17.75 |
3.41 |
0.0 |
0.0 |
0 |
|
|
387761 |
134986767 |
1 |
ClOSC10H19 |
ABCD10E19 |
-85.91 |
0.73 |
-9.04 |
-0.23 |
0 |
|
|
387762 |
134986773 |
1 |
N2Cl3C9H15 |
A2B3C9D15 |
-20.6 |
1.12 |
-9.24 |
-0.56 |
0 |
|
|
387763 |
134986775 |
1 |
NPO3C9H18 |
ABC3D9E18 |
-183.47 |
5.93 |
-9.6 |
1.13 |
0 |
|
|
387764 |
134986798 |
1 |
SBr2Cl3H7C11 |
AB2C3D7E11 |
39.85 |
4.1 |
-9.1 |
-1.23 |
0 |
|
|
387765 |
134986800 |
1 |
SSeC8H12 |
ABC8D12 |
48.84 |
2.6 |
-8.41 |
-0.27 |
0 |
|
|
387766 |
134986802 |
1 |
N2O3C14H16 |
A2B3C14D16 |
-75.19 |
9.41 |
-9.34 |
-1.0 |
0 |
|
|
387767 |
134986812 |
1 |
C13H16 |
A13B16 |
36.53 |
0.6 |
-9.13 |
0.32 |
0 |
|
|
387768 |
134986822 |
1 |
S2C15H20 |
A2B15C20 |
35.51 |
2.3 |
-8.65 |
-0.31 |
0 |
|
|
387769 |
134986844 |
1 |
OSCl2C7H10 |
ABC2D7E10 |
-51.06 |
3.05 |
-9.47 |
-1.55 |
0 |
|
|
387770 |
134986850 |
1 |
NO3C13H19 |
AB3C13D19 |
-126.16 |
5.42 |
-10.32 |
0.18 |
0 |
|
|
387771 |
134986854 |
2 |
OC6H9 |
AB6C9 |
-48.26 |
1.81 |
-9.13 |
0.21 |
0 |
|
|
387773 |
134986859 |
1 |
O3C10H18 |
A3B10C18 |
-153.31 |
2.72 |
-9.61 |
1.98 |
0 |
|
|
387774 |
134986860 |
1 |
BrNO2C9H10 |
ABC2D9E10 |
16.75 |
1.68 |
-10.17 |
-1.27 |
0 |
|
|
387775 |
134986863 |
2 |
SC4H9 |
AB4C9 |
-32.78 |
2.75 |
-8.48 |
0.59 |
0 |
|
|
387776 |
134986875 |
1 |
NC13H15 |
AB13C15 |
20.88 |
2.92 |
-8.98 |
-0.52 |
0 |
|
|
387777 |
134986893 |
1 |
NSH15C16 |
ABC15D16 |
65.16 |
2.64 |
-8.07 |
-0.06 |
0 |
|
|
387778 |
134986897 |
1 |
NOC12H15 |
ABC12D15 |
-36.25 |
3.57 |
-8.63 |
-0.03 |
0 |
|
|
387779 |
134986904 |
1 |
NO2C13H15 |
AB2C13D15 |
-62.87 |
1.6 |
-8.43 |
-0.25 |
0 |
|
|
387780 |
134986906 |
1 |
SN2O2C12H12 |
AB2C2D12E12 |
-23.38 |
2.84 |
-8.65 |
-0.45 |
0 |
|
|
387781 |
134986908 |
1 |
O2N3H9C13 |
A2B3C9D13 |
39.53 |
3.52 |
-9.38 |
-1.36 |
0 |
|
|
387782 |
134986913 |
1 |
INH10C12 |
ABC10D12 |
72.81 |
2.38 |
-9.21 |
-1.04 |
0 |
|
|
387783 |
134986915 |
1 |
ON3C11H13 |
AB3C11D13 |
-6.3 |
5.11 |
-7.9 |
-0.67 |
0 |
|
|
387784 |
134986916 |
1 |
IN2O2C9H15 |
AB2C2D9E15 |
-48.33 |
6.02 |
-8.4 |
-0.63 |
1 |
|
|
387785 |
134986917 |
1 |
N2O2C9H15 |
A2B2C9D15 |
-55.48 |
3.2 |
0.0 |
0.0 |
0 |
|
|
387786 |
134986918 |
1 |
ON2C14H16 |
AB2C14D16 |
-9.94 |
4.4 |
-8.7 |
-0.8 |
0 |
|
|
387787 |
134986920 |
1 |
BPC15H26 |
ABC15D26 |
-29.85 |
2.26 |
-8.44 |
0.03 |
0 |
|
|
387788 |
134986933 |
1 |
ION2C9H9 |
ABC2D9E9 |
35.28 |
4.12 |
-7.87 |
-1.96 |
0 |
|
|
387789 |
134986936 |
1 |
NO4H11C13 |
AB4C11D13 |
-109.47 |
2.18 |
-9.24 |
-1.22 |
0 |
|
|
387790 |
134986941 |
1 |
N2S2O3C12H18 |
A2B2C3D12E18 |
-116.99 |
4.93 |
-8.14 |
-0.94 |
0 |
|
|
387791 |
134986942 |
1 |
NO3C14H17 |
AB3C14D17 |
-107.45 |
1.19 |
-8.47 |
-0.13 |
0 |
|
|
387792 |
134986948 |
1 |
NBr2H9C12 |
AB2C9D12 |
54.29 |
5.33 |
-8.23 |
-1.55 |
0 |
|
|
387793 |
134986951 |
1 |
NO2C10H11 |
AB2C10D11 |
-60.93 |
4.47 |
-8.87 |
-0.28 |
0 |
|
|
387794 |
134986956 |
1 |
OSeH8C10 |
ABC8D10 |
-7.11 |
5.26 |
-8.77 |
-1.1 |
0 |
|
|
387795 |
134986958 |
2 |
O2C7H8 |
A2B7C8 |
-133.98 |
3.2 |
-8.69 |
-0.28 |
0 |
|
|
387796 |
134986959 |
1 |
O2N3C12H13 |
A2B3C12D13 |
-35.51 |
7.29 |
-9.19 |
-0.74 |
0 |