List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
338722 |
127259733 |
1 |
NSH25C28 |
ABC25D28 |
102.21 |
3.72 |
-8.02 |
-0.27 |
0 |
|
|
338723 |
127259734 |
1 |
NOC24H33 |
ABC24D33 |
-16.93 |
3.79 |
-8.02 |
0.06 |
0 |
|
|
338724 |
127259735 |
1 |
NC20H23 |
AB20C23 |
68.72 |
1.86 |
-7.92 |
0.28 |
0 |
|
|
338725 |
127259736 |
2 |
NOC6H7 |
ABC6D7 |
41.34 |
10.47 |
-8.42 |
-1.39 |
0 |
|
|
338726 |
127259737 |
1 |
ON2H14C19 |
AB2C14D19 |
64.8 |
2.61 |
-8.22 |
-0.81 |
0 |
|
|
338727 |
127259738 |
1 |
NOC18H27 |
ABC18D27 |
-28.36 |
1.61 |
-7.71 |
0.38 |
0 |
|
|
338728 |
127259739 |
1 |
NOC19H21 |
ABC19D21 |
41.45 |
2.26 |
-8.25 |
0.25 |
0 |
|
|
338729 |
127259740 |
1 |
ClN2H15C17 |
AB2C15D17 |
78.47 |
5.61 |
-8.12 |
-1.22 |
0 |
|
|
338730 |
127259741 |
1 |
NS2H17C23 |
AB2C17D23 |
131.87 |
3.65 |
-8.44 |
-0.58 |
0 |
|
|
338731 |
127259742 |
1 |
N2H22C23 |
A2B22C23 |
86.21 |
0.97 |
-7.75 |
-0.17 |
0 |
|
|
338732 |
127259743 |
2 |
NOC18H28 |
ABC18D28 |
-54.75 |
10.21 |
-8.36 |
-1.32 |
0 |
|
|
338733 |
127259744 |
2 |
NC16H25 |
AB16C25 |
-15.75 |
6.2 |
-8.1 |
-0.43 |
0 |
|
|
338734 |
127259745 |
2 |
NC11H15 |
AB11C15 |
32.54 |
6.04 |
-8.08 |
-0.46 |
0 |
|
|
338735 |
127259746 |
1 |
NC16H17 |
AB16C17 |
39.17 |
1.32 |
-8.33 |
0.28 |
0 |
|
|
338736 |
127259747 |
1 |
N3O3C8H9 |
A3B3C8D9 |
-25.52 |
2.95 |
-10.01 |
-1.61 |
0 |
|
|
338737 |
127259748 |
1 |
NSO2C12H13 |
ABC2D12E13 |
-56.93 |
6.72 |
-9.02 |
-0.34 |
0 |
|
|
338738 |
127259749 |
1 |
NOC19H21 |
ABC19D21 |
-5.28 |
4.58 |
-8.69 |
-0.06 |
0 |
|
|
338739 |
127259750 |
1 |
ON3C16H17 |
AB3C16D17 |
33.14 |
4.26 |
-8.52 |
-0.05 |
0 |
|
|
338740 |
127259751 |
1 |
BrO3C18H19 |
AB3C18D19 |
-90.67 |
3.02 |
-9.06 |
-0.23 |
0 |
|
|
338741 |
127259752 |
1 |
NO3C17H17 |
AB3C17D17 |
-84.96 |
2.03 |
-9.64 |
-0.46 |
0 |
|
|
338742 |
127259753 |
4 |
OC3H4 |
AB3C4 |
-157.48 |
2.21 |
-9.72 |
-0.02 |
0 |
|
|
338743 |
127259754 |
1 |
Cl2N2O2H14C19 |
A2B2C2D14E19 |
-10.01 |
2.27 |
-8.68 |
-0.56 |
0 |
|
|
338744 |
127259755 |
1 |
SO4C14H18 |
AB4C14D18 |
-169.84 |
1.5 |
-8.97 |
-0.02 |
0 |
|
|
338745 |
127259756 |
1 |
NCl2O3H19C23 |
AB2C3D19E23 |
-70.23 |
6.07 |
-9.54 |
-0.82 |
0 |
|
|
338746 |
127259757 |
1 |
ClNO3C12H12 |
ABC3D12E12 |
-121.91 |
4.21 |
-9.9 |
-0.36 |
0 |
|
|
338747 |
127259758 |
1 |
ClO2C14H19 |
AB2C14D19 |
-104.75 |
3.51 |
-9.63 |
0.07 |
0 |
|
|
338748 |
127259759 |
1 |
O5C19H22 |
A5B19C22 |
-160.88 |
1.73 |
-8.33 |
0.09 |
0 |
|
|
338749 |
127259760 |
1 |
O3C17H22 |
A3B17C22 |
-113.57 |
3.47 |
-9.5 |
0.23 |
0 |
|
|
338750 |
127259761 |
1 |
O2F3C13H15 |
A2B3C13D15 |
-249.44 |
4.02 |
-9.71 |
-0.01 |
0 |
|
|
338751 |
127259762 |
1 |
O2F3C17H23 |
A2B3C17D23 |
-268.88 |
4.2 |
-9.65 |
0.08 |
0 |
|
|
338752 |
127259763 |
1 |
N2O3H18C20 |
A2B3C18D20 |
-66.39 |
2.97 |
-8.78 |
-0.73 |
0 |
|
|
338753 |
127259764 |
1 |
N3O4C15H19 |
A3B4C15D19 |
-149.09 |
6.71 |
-9.5 |
0.07 |
0 |
|
|
338754 |
127259765 |
1 |
NO2C12H17 |
AB2C12D17 |
-84.8 |
2.89 |
-9.39 |
0.16 |
0 |
|
|
338755 |
127259766 |
1 |
NO3C21H31 |
AB3C21D31 |
-149.7 |
2.1 |
-8.57 |
-0.06 |
0 |
|
|
338756 |
127259767 |
1 |
ClNO3C21H32 |
ABC3D21E32 |
-183.69 |
3.12 |
-8.87 |
-0.02 |
0 |
|
|
338757 |
127259768 |
1 |
NO3C21H31 |
AB3C21D31 |
-148.27 |
4.85 |
-8.62 |
0.09 |
0 |
|
|
338758 |
127259769 |
1 |
NO4C12H15 |
AB4C12D15 |
-171.43 |
5.62 |
-9.77 |
-0.07 |
0 |
|
|
338759 |
127259770 |
1 |
NO2C14H21 |
AB2C14D21 |
-95.74 |
2.37 |
-9.39 |
0.15 |
0 |
|
|
338760 |
127259771 |
1 |
NO3C18H29 |
AB3C18D29 |
-139.46 |
3.97 |
-8.58 |
0.06 |
0 |
|
|
338761 |
127259772 |
1 |
O3C11H12 |
A3B11C12 |
-83.26 |
3.75 |
-8.9 |
0.02 |
0 |
|
|
338762 |
127259773 |
1 |
O2H16C17 |
A2B16C17 |
-33.6 |
2.66 |
-9.11 |
0.04 |
0 |
|
|
338763 |
127259774 |
1 |
SO4H14C15 |
AB4C14D15 |
-113.75 |
4.11 |
-9.46 |
-0.6 |
0 |
|
|
338764 |
127259775 |
1 |
Cl2O3H10C15 |
A2B3C10D15 |
-81.53 |
4.37 |
-9.48 |
-0.87 |
0 |
|
|
338765 |
127259776 |
1 |
BrO4H15C18 |
AB4C15D18 |
-93.46 |
2.4 |
-8.78 |
-0.36 |
0 |
|
|
338766 |
127259777 |
1 |
ClO4H15C18 |
AB4C15D18 |
-106.53 |
2.21 |
-8.72 |
-0.31 |
0 |
|
|
338767 |
127259778 |
1 |
BrO4H9C10 |
AB4C9D10 |
-139.41 |
5.07 |
-10.19 |
-1.29 |
0 |
|
|
338768 |
127259779 |
1 |
NO3C12H15 |
AB3C12D15 |
-118.47 |
3.67 |
-9.84 |
-0.16 |
0 |
|
|
338769 |
127259780 |
1 |
NO2C18H21 |
AB2C18D21 |
-50.26 |
3.01 |
-8.3 |
0.14 |
0 |
|
|
338770 |
127259781 |
1 |
NSO4C23H23 |
ABC4D23E23 |
-111.78 |
5.71 |
-8.93 |
-0.45 |
0 |
|
|
338771 |
127259782 |
1 |
NO2C18H21 |
AB2C18D21 |
-50.97 |
3.06 |
-9.32 |
0.23 |
0 |