List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
211695 |
81049721 |
1 |
BrNOC12H14 |
ABCD12E14 |
-4.04 |
3.47 |
-9.06 |
-0.56 |
0 |
|
|
211696 |
81049769 |
1 |
N2O2C17H34 |
A2B2C17D34 |
-136.16 |
5.42 |
-8.77 |
1.34 |
0 |
|
|
211697 |
81049833 |
1 |
NSC15H21 |
ABC15D21 |
5.28 |
3.27 |
-8.27 |
-0.25 |
0 |
|
|
211698 |
81049834 |
1 |
BrNSC12H14 |
ABCD12E14 |
21.65 |
1.1 |
-8.75 |
-0.73 |
0 |
|
|
211699 |
81049858 |
1 |
BrClNO2H13C15 |
ABCD2E13F15 |
-55.34 |
1.76 |
-9.26 |
-0.77 |
0 |
|
|
211700 |
81049871 |
1 |
N2O3C13H26 |
A2B3C13D26 |
-184.81 |
1.48 |
-9.77 |
0.98 |
0 |
|
|
211701 |
81049872 |
1 |
SN2O4C12H24 |
AB2C4D12E24 |
-208.72 |
4.13 |
-9.54 |
0.58 |
0 |
|
|
211702 |
81049929 |
1 |
ON2C18H28 |
AB2C18D28 |
-56.65 |
4.99 |
-8.83 |
0.27 |
0 |
|
|
211703 |
81049930 |
1 |
ON2C18H26 |
AB2C18D26 |
-52.07 |
3.84 |
-8.67 |
-0.01 |
0 |
|
|
211704 |
81049941 |
1 |
NOC18H27 |
ABC18D27 |
-45.8 |
2.04 |
-8.61 |
-0.07 |
0 |
|
|
211705 |
81049975 |
1 |
ClNOC15H20 |
ABCD15E20 |
-42.81 |
2.83 |
-8.62 |
-0.3 |
0 |
|
|
211706 |
81049998 |
1 |
BrFNCl2H15C16 |
ABCD2E15F16 |
-27.96 |
1.33 |
-9.28 |
-0.62 |
0 |
|
|
211707 |
81049999 |
1 |
FNCl3H15C16 |
ABC3D15E16 |
-35.99 |
4.52 |
-9.33 |
-0.53 |
0 |
|
|
211708 |
81050005 |
1 |
ClNF2C17H18 |
ABC2D17E18 |
-76.56 |
3.77 |
-9.0 |
-0.47 |
0 |
|
|
211709 |
81050070 |
1 |
N3O3C15H23 |
A3B3C15D23 |
-126.39 |
4.45 |
-8.61 |
-0.65 |
0 |
|
|
211710 |
81050153 |
1 |
N4C15H26 |
A4B15C26 |
4.95 |
3.04 |
-8.29 |
0.22 |
0 |
|
|
211711 |
81050181 |
1 |
FCl3H12C15 |
AB3C12D15 |
-47.55 |
1.96 |
-9.48 |
-0.6 |
0 |
|
|
211712 |
81050248 |
1 |
N3O3C11H15 |
A3B3C11D15 |
-125.99 |
3.76 |
-9.1 |
-0.35 |
0 |
|
|
211713 |
81050341 |
1 |
FICl2H10C14 |
ABC2D10E14 |
-13.34 |
2.46 |
-9.55 |
-1.05 |
0 |
|
|
211714 |
81050437 |
1 |
BrClFC17H17 |
ABCD17E17 |
-38.81 |
2.95 |
-9.4 |
-0.83 |
0 |
|
|
211715 |
81050506 |
2 |
ClF3H3C5 |
AB3C3D5 |
-315.07 |
2.59 |
-9.88 |
-0.92 |
0 |
|
|
211716 |
81050507 |
1 |
FCl2C16H23 |
AB2C16D23 |
-101.98 |
1.41 |
-9.56 |
-0.46 |
0 |
|
|
211717 |
81050757 |
1 |
BrClFH7C8 |
ABCD7E8 |
-46.29 |
2.43 |
-9.52 |
-0.9 |
0 |
|
|
211718 |
81050781 |
1 |
ON4C14H24 |
AB4C14D24 |
-47.2 |
3.1 |
-9.15 |
-0.27 |
0 |
|
|
211719 |
81050817 |
1 |
FOCl2H13C15 |
ABC2D13E15 |
-66.83 |
2.26 |
-9.08 |
-0.74 |
0 |
|
|
211720 |
81050864 |
1 |
ON3C15H25 |
AB3C15D25 |
-39.15 |
1.25 |
-9.1 |
-0.07 |
0 |
|
|
211721 |
81050888 |
1 |
FSCl3H8C12 |
ABC3D8E12 |
-33.04 |
2.59 |
-9.32 |
-0.97 |
0 |
|
|
211722 |
81050897 |
1 |
BrClFSH13C15 |
ABCDE13F15 |
-20.36 |
3.03 |
-8.92 |
-1.01 |
0 |
|
|
211723 |
81051005 |
1 |
N3C16H27 |
A3B16C27 |
-12.61 |
3.22 |
-8.73 |
0.16 |
0 |
|
|
211724 |
81051043 |
1 |
O2N3C13H15 |
A2B3C13D15 |
-29.29 |
2.39 |
-9.87 |
-0.87 |
0 |
|
|
211725 |
81051050 |
1 |
FCl3H10C14 |
AB3C10D14 |
-39.13 |
2.96 |
-9.62 |
-0.7 |
0 |
|
|
211726 |
81051097 |
3 |
NC4H7 |
AB4C7 |
-15.61 |
3.5 |
-8.62 |
0.35 |
0 |
|
|
211727 |
81051099 |
1 |
ON4C14H22 |
AB4C14D22 |
-34.08 |
3.31 |
-9.27 |
-0.18 |
0 |
|
|
211728 |
81051123 |
1 |
N3O3C13H17 |
A3B3C13D17 |
-102.56 |
6.76 |
-9.72 |
-0.55 |
0 |
|
|
211729 |
81051140 |
1 |
ClBr2F2H9C14 |
AB2C2D9E14 |
-63.71 |
1.11 |
-9.66 |
-1.1 |
0 |
|
|
211730 |
81051149 |
1 |
BrClFO2C12H13 |
ABCD2E12F13 |
-123.88 |
2.07 |
-9.47 |
-0.75 |
0 |
|
|
211731 |
81051433 |
1 |
N2O3C12H18 |
A2B3C12D18 |
-126.48 |
6.73 |
-9.29 |
-0.37 |
0 |
|
|
211732 |
81051663 |
1 |
ON3C12H17 |
AB3C12D17 |
-13.11 |
5.83 |
-9.64 |
-0.7 |
0 |
|
|
211733 |
81051666 |
2 |
NOC8H12 |
ABC8D12 |
-103.95 |
4.81 |
-9.28 |
-0.34 |
0 |
|
|
211734 |
81051670 |
2 |
ON2C7H8 |
AB2C7D8 |
-42.21 |
3.51 |
-9.3 |
-0.72 |
0 |
|
|
211735 |
81051678 |
1 |
N4C15H24 |
A4B15C24 |
15.07 |
4.82 |
-9.02 |
-0.13 |
0 |
|
|
211736 |
81051749 |
1 |
SO2N3C13H15 |
AB2C3D13E15 |
-49.08 |
4.65 |
-9.26 |
-0.88 |
0 |
|
|
211737 |
81051776 |
1 |
BrSN3C14H14 |
ABC3D14E14 |
60.4 |
2.68 |
-9.22 |
-0.95 |
0 |
|
|
211738 |
81051894 |
1 |
SO2N3C13H15 |
AB2C3D13E15 |
-49.96 |
4.02 |
-9.19 |
-0.64 |
0 |
|
|
211739 |
81051914 |
1 |
SN2C16H16 |
AB2C16D16 |
53.4 |
2.27 |
-8.8 |
-0.8 |
0 |
|
|
211740 |
81052077 |
1 |
SN3C16H17 |
AB3C16D17 |
62.23 |
3.86 |
-9.02 |
-0.54 |
0 |
|
|
211741 |
81052756 |
1 |
N2O2C15H22 |
A2B2C15D22 |
-108.52 |
5.5 |
-8.97 |
-0.34 |
0 |
|
|
211742 |
81052836 |
1 |
N2O2C13H16 |
A2B2C13D16 |
-44.9 |
3.0 |
-9.2 |
-0.31 |
0 |
|
|
211743 |
81053022 |
1 |
N2O3C14H18 |
A2B3C14D18 |
-80.54 |
4.78 |
-8.51 |
-0.71 |
0 |
|
|
211744 |
81053049 |
1 |
ON3C13H23 |
AB3C13D23 |
-21.01 |
1.98 |
-8.85 |
0.18 |
0 |