List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
374843 |
131349507 |
1 |
N2O3C10H12 |
A2B3C10D12 |
-98.49 |
2.23 |
-9.08 |
-1.21 |
0 |
|
|
374844 |
131349508 |
1 |
N2O3C10H12 |
A2B3C10D12 |
-85.9 |
1.27 |
-8.62 |
-0.7 |
0 |
|
|
374845 |
131349510 |
1 |
ON3C11H11 |
AB3C11D11 |
23.97 |
2.7 |
-9.88 |
-0.7 |
0 |
|
|
374846 |
131349515 |
1 |
N6C9H10 |
A6B9C10 |
120.03 |
5.86 |
-9.32 |
-0.68 |
0 |
|
|
374847 |
131349518 |
1 |
BrNOH6C9 |
ABCD6E9 |
44.72 |
4.13 |
-10.1 |
-1.28 |
0 |
|
|
374848 |
131349520 |
1 |
N5H7C10 |
A5B7C10 |
133.27 |
3.81 |
-9.27 |
-1.65 |
0 |
|
|
374849 |
131349521 |
1 |
BrN2H9C13 |
AB2C9D13 |
76.55 |
2.8 |
-9.74 |
-0.82 |
0 |
|
|
374850 |
131349522 |
1 |
BrN2H9C13 |
AB2C9D13 |
76.78 |
5.61 |
-9.56 |
-0.99 |
0 |
|
|
374851 |
131349550 |
1 |
BrNOF3H7C10 |
ABCD3E7F10 |
-168.65 |
1.15 |
-10.12 |
-1.48 |
0 |
|
|
374852 |
131349551 |
1 |
BrNO2C10H10 |
ABC2D10E10 |
-51.05 |
2.46 |
-9.32 |
-1.03 |
0 |
|
|
374853 |
131349553 |
1 |
BrClNOH7C9 |
ABCDE7F9 |
-19.36 |
2.83 |
-9.77 |
-1.28 |
0 |
|
|
374854 |
131349554 |
1 |
BrFNOH7C9 |
ABCDE7F9 |
-54.54 |
2.35 |
-9.97 |
-1.32 |
0 |
|
|
374855 |
131349555 |
1 |
BrFNOH7C9 |
ABCDE7F9 |
-57.12 |
2.79 |
-9.82 |
-1.3 |
0 |
|
|
374856 |
131349558 |
1 |
BrN2O3H7C9 |
AB2C3D7E9 |
-9.05 |
1.73 |
-10.19 |
-1.91 |
0 |
|
|
374857 |
131349560 |
1 |
ClINOH7C9 |
ABCDE7F9 |
-3.73 |
2.79 |
-9.87 |
-1.55 |
0 |
|
|
374858 |
131349566 |
1 |
NO2C11H15 |
AB2C11D15 |
-67.7 |
4.16 |
-8.59 |
0.23 |
0 |
|
|
374859 |
131349568 |
1 |
ClNOF2H6C8 |
ABCD2E6F8 |
-116.34 |
1.89 |
-9.38 |
-0.76 |
0 |
|
|
374860 |
131349569 |
1 |
NO4C11H15 |
AB4C11D15 |
-127.94 |
4.46 |
-8.83 |
0.11 |
0 |
|
|
374861 |
131349570 |
1 |
NSO2Cl3C9H10 |
ABC2D3E9F10 |
-86.13 |
3.47 |
-9.5 |
-0.73 |
0 |
|
|
374862 |
131349574 |
1 |
ON2C13H18 |
AB2C13D18 |
-13.97 |
5.33 |
-8.86 |
0.57 |
0 |
|
|
374863 |
131349575 |
1 |
NO3H9C11 |
AB3C9D11 |
-37.68 |
5.43 |
-8.68 |
-0.67 |
0 |
|
|
374864 |
131349577 |
1 |
NO3H9C11 |
AB3C9D11 |
-50.76 |
1.58 |
-8.85 |
-0.7 |
0 |
|
|
374865 |
131349578 |
1 |
NO3H9C11 |
AB3C9D11 |
-72.7 |
4.28 |
-9.16 |
-1.16 |
0 |
|
|
374866 |
131349580 |
1 |
NO3H9C11 |
AB3C9D11 |
-71.6 |
9.34 |
-8.61 |
-1.23 |
0 |
|
|
374867 |
131349585 |
1 |
OSN3C10H13 |
ABC3D10E13 |
14.68 |
3.06 |
-9.15 |
-0.98 |
0 |
|
|
374868 |
131349587 |
1 |
OSN3C10H13 |
ABC3D10E13 |
9.56 |
4.15 |
-9.22 |
-0.59 |
0 |
|
|
374869 |
131349590 |
1 |
NSO2C11H13 |
ABC2D11E13 |
-38.72 |
5.84 |
-8.39 |
-0.67 |
0 |
|
|
374870 |
131349594 |
1 |
BrN2O2C6H7 |
AB2C2D6E7 |
-48.43 |
4.15 |
-9.62 |
-0.12 |
0 |
|
|
374871 |
131349606 |
1 |
BrN2C12H13 |
AB2C12D13 |
54.9 |
3.37 |
-8.93 |
0.11 |
0 |
|
|
374872 |
131349608 |
1 |
N4C11H16 |
A4B11C16 |
44.74 |
3.47 |
-8.41 |
0.38 |
0 |
|
|
374873 |
131349611 |
1 |
N4C11H16 |
A4B11C16 |
42.83 |
2.76 |
-8.33 |
0.55 |
0 |
|
|
374874 |
131349614 |
1 |
ClN4H9C10 |
AB4C9D10 |
72.68 |
3.53 |
-8.34 |
-0.57 |
0 |
|
|
374875 |
131349615 |
1 |
ClOSF2H5C10 |
ABCD2E5F10 |
-98.86 |
2.71 |
-9.44 |
-1.77 |
0 |
|
|
374876 |
131349617 |
1 |
ClOSF2H5C10 |
ABCD2E5F10 |
-98.0 |
3.26 |
-9.42 |
-1.41 |
0 |
|
|
374877 |
131349618 |
1 |
ClN4H9C10 |
AB4C9D10 |
69.04 |
4.21 |
-8.15 |
-0.68 |
0 |
|
|
374878 |
131349622 |
1 |
BrOSF2H7C10 |
ABCD2E7F10 |
-110.93 |
2.82 |
-9.08 |
-1.12 |
0 |
|
|
374879 |
131349627 |
1 |
OF2N2C10H10 |
AB2C2D10E10 |
-101.11 |
4.92 |
-9.49 |
-0.54 |
0 |
|
|
374880 |
131349628 |
1 |
BrOSF2H7C10 |
ABCD2E7F10 |
-109.28 |
3.69 |
-8.83 |
-1.18 |
0 |
|
|
374881 |
131349633 |
1 |
SN2O4C7H14 |
AB2C4D7E14 |
-173.03 |
4.57 |
-10.01 |
-0.03 |
0 |
|
|
374882 |
131349636 |
1 |
N2F5H7C8 |
A2B5C7D8 |
-222.09 |
1.84 |
-10.29 |
-0.39 |
0 |
|
|
374883 |
131349639 |
1 |
BrN2F5H6C8 |
AB2C5D6E8 |
-230.9 |
4.5 |
-10.3 |
-1.13 |
0 |
|
|
374884 |
131349643 |
1 |
NOF5H8C9 |
ABC5D8E9 |
-279.99 |
1.84 |
-9.37 |
-0.23 |
0 |
|
|
374885 |
131349650 |
1 |
O2F3H7C8 |
A2B3C7D8 |
-225.32 |
3.52 |
-9.56 |
-0.36 |
0 |
|
|
374886 |
131349651 |
1 |
O2F3H7C8 |
A2B3C7D8 |
-222.23 |
1.75 |
-9.22 |
-0.52 |
0 |
|
|
374887 |
131349652 |
1 |
ISN2O2H5C10 |
ABC2D2E5F10 |
80.94 |
5.82 |
-9.56 |
-2.12 |
0 |
|
|
374888 |
131349653 |
1 |
ISN2O2H5C10 |
ABC2D2E5F10 |
80.36 |
4.9 |
-9.56 |
-2.12 |
0 |
|
|
374889 |
131349655 |
1 |
ISN2O2H5C10 |
ABC2D2E5F10 |
78.77 |
3.17 |
-9.63 |
-1.97 |
0 |
|
|
374890 |
131349667 |
1 |
BrON3H6C10 |
ABC3D6E10 |
50.75 |
2.89 |
-9.82 |
-1.18 |
0 |
|
|
374891 |
131349675 |
2 |
NO2H4C5 |
AB2C4D5 |
-42.25 |
4.8 |
-10.57 |
-1.98 |
0 |
|
|
374892 |
131349676 |
2 |
NO2H4C5 |
AB2C4D5 |
-45.08 |
5.27 |
-10.65 |
-1.8 |
0 |
|
|
374893 |
131349677 |
2 |
NO2H4C5 |
AB2C4D5 |
-42.98 |
6.31 |
-10.71 |
-1.68 |
0 |
|
|
374894 |
131349690 |
1 |
NO2C10H11 |
AB2C10D11 |
-50.37 |
7.05 |
-9.35 |
-0.29 |
0 |
|
|
374895 |
131349693 |
1 |
OSN3C8H11 |
ABC3D8E11 |
-12.09 |
3.51 |
-8.17 |
-0.31 |
0 |
|
|
374896 |
131349698 |
1 |
NO2C10H11 |
AB2C10D11 |
-43.78 |
4.29 |
-8.8 |
-0.71 |
0 |
|
|
374897 |
131349701 |
1 |
NO2C10H11 |
AB2C10D11 |
-44.3 |
3.82 |
-8.9 |
-0.59 |
0 |
|
|
374898 |
131349703 |
2 |
FOC5H6 |
ABC5D6 |
-181.42 |
3.83 |
-8.61 |
-0.32 |
0 |
|
|
374899 |
131349705 |
2 |
FOC5H6 |
ABC5D6 |
-177.86 |
1.25 |
-8.58 |
-0.32 |
0 |
|
|
374900 |
131349706 |
2 |
FOC5H6 |
ABC5D6 |
-185.15 |
3.29 |
-8.97 |
-0.1 |
0 |
|
|
374901 |
131349713 |
2 |
FOC5H6 |
ABC5D6 |
-181.37 |
0.8 |
-8.75 |
-0.19 |
0 |
|
|
374902 |
131349714 |
2 |
FOC5H6 |
ABC5D6 |
-181.87 |
2.81 |
-8.84 |
-0.22 |
0 |
|
|
374903 |
131349718 |
2 |
FOC5H6 |
ABC5D6 |
-178.15 |
3.81 |
-9.18 |
-0.36 |
0 |
|
|
374904 |
131349720 |
2 |
FOC5H6 |
ABC5D6 |
-187.9 |
5.16 |
-9.2 |
0.04 |
0 |
|
|
374905 |
131349724 |
1 |
IOF2H5C7 |
ABC2D5E7 |
-98.9 |
2.02 |
-9.85 |
-1.44 |
0 |
|
|
374906 |
131349725 |
1 |
NOF4H5C9 |
ABC4D5E9 |
-198.74 |
5.04 |
-10.06 |
-1.24 |
0 |
|
|
374907 |
131349730 |
1 |
ClIOF2H4C8 |
ABCD2E4F8 |
-92.71 |
1.25 |
-9.97 |
-1.55 |
0 |
|
|
374908 |
131349733 |
4 |
FHOC2 |
ABCD2 |
-347.4 |
5.5 |
-10.33 |
-1.74 |
0 |
|
|
374909 |
131349738 |
1 |
BrIOF2H4C8 |
ABCD2E4F8 |
-83.61 |
3.82 |
-10.22 |
-1.68 |
0 |
|
|
374910 |
131349740 |
1 |
ClIOF2H4C8 |
ABCD2E4F8 |
-95.11 |
2.02 |
-9.92 |
-1.52 |
0 |
|
|
374911 |
131349741 |
1 |
ClIOF2H4C8 |
ABCD2E4F8 |
-95.23 |
3.86 |
-10.28 |
-1.79 |
0 |
|
|
374912 |
131349742 |
1 |
ClIOF2H4C8 |
ABCD2E4F8 |
-91.35 |
1.65 |
-9.93 |
-1.49 |
0 |
|
|
374913 |
131349743 |
1 |
ClIOF2H4C8 |
ABCD2E4F8 |
-91.2 |
4.66 |
-10.08 |
-1.69 |
0 |
|
|
374914 |
131349746 |
1 |
IOF2H3C6 |
ABC2D3E6 |
-90.05 |
1.04 |
-9.58 |
-1.37 |
0 |
|
|
374915 |
131349748 |
2 |
OF2H3C4 |
AB2C3D4 |
-282.97 |
4.27 |
-9.98 |
-0.83 |
0 |
|
|
374916 |
131349749 |
2 |
OF2H3C4 |
AB2C3D4 |
-277.06 |
1.41 |
-10.02 |
-1.08 |
0 |
|
|
374917 |
131349756 |
1 |
ClIOF2H4C8 |
ABCD2E4F8 |
-92.64 |
2.03 |
-10.03 |
-1.66 |
0 |