List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
275950 |
103819370 |
1 |
BrN2O3H13C14 |
AB2C3D13E14 |
-64.24 |
3.55 |
-8.86 |
-0.68 |
0 |
|
|
275951 |
103819393 |
1 |
BrON4H9C10 |
ABC4D9E10 |
30.93 |
2.93 |
-9.41 |
-0.86 |
0 |
|
|
275952 |
103819400 |
1 |
BrOSN3H8C10 |
ABCD3E8F10 |
15.07 |
4.74 |
-9.16 |
-1.22 |
0 |
|
|
275953 |
103819423 |
1 |
BrOSN2H9C11 |
ABCD2E9F11 |
4.59 |
3.98 |
-9.17 |
-1.06 |
0 |
|
|
275954 |
103819428 |
1 |
BrON2H11C13 |
ABC2D11E13 |
0.26 |
2.91 |
-9.24 |
-0.67 |
0 |
|
|
275955 |
103819439 |
1 |
BrN3O3H10C13 |
AB3C3D10E13 |
-2.25 |
4.25 |
-9.61 |
-1.6 |
0 |
|
|
275956 |
103819440 |
1 |
BrN2O2H13C14 |
AB2C2D13E14 |
-35.39 |
1.52 |
-9.06 |
-0.82 |
0 |
|
|
275957 |
103819441 |
1 |
BrOCl2N3H6C11 |
ABC2D3E6F11 |
10.71 |
4.42 |
-9.28 |
-1.68 |
0 |
|
|
275958 |
103819455 |
1 |
BrOSN2H11C12 |
ABCD2E11F12 |
0.07 |
4.49 |
-9.18 |
-1.03 |
0 |
|
|
275959 |
103819460 |
1 |
BrOF3N3H7C12 |
ABC3D3E7F12 |
-135.43 |
3.22 |
-9.64 |
-1.82 |
0 |
|
|
275960 |
103819463 |
1 |
BrON5C10H10 |
ABC5D10E10 |
35.88 |
3.53 |
-9.57 |
-0.95 |
0 |
|
|
275961 |
103819476 |
1 |
BrON2C15H15 |
ABC2D15E15 |
-11.5 |
2.42 |
-9.3 |
-0.69 |
0 |
|
|
275962 |
103819491 |
1 |
BrOCl2N2H7C12 |
ABC2D2E7F12 |
-6.62 |
2.41 |
-9.37 |
-1.29 |
0 |
|
|
275963 |
103819506 |
1 |
BrON3H10C11 |
ABC3D10E11 |
8.69 |
4.33 |
-9.12 |
-0.75 |
0 |
|
|
275964 |
103819509 |
1 |
BrFON2H10C13 |
ABCD2E10F13 |
-46.43 |
2.2 |
-9.35 |
-0.76 |
0 |
|
|
275965 |
103819517 |
1 |
BrON3H10C15 |
ABC3D10E15 |
38.92 |
0.89 |
-9.39 |
-1.29 |
0 |
|
|
275966 |
103819523 |
1 |
BrN2O2C12H15 |
AB2C2D12E15 |
-78.01 |
4.33 |
-9.25 |
-0.66 |
0 |
|
|
275967 |
103819543 |
1 |
NO3C11H15 |
AB3C11D15 |
-112.24 |
2.1 |
-9.35 |
-0.92 |
0 |
|
|
275968 |
103819551 |
1 |
BrClNO4C16H21 |
ABCD4E16F21 |
-191.9 |
2.87 |
-9.54 |
-0.95 |
0 |
|
|
275969 |
103819566 |
1 |
BrClNO4H19C24 |
ABCD4E19F24 |
-111.07 |
4.16 |
-9.01 |
-1.03 |
0 |
|
|
275970 |
103819569 |
1 |
BrClNO4C19H19 |
ABCD4E19F19 |
-157.42 |
4.74 |
-9.26 |
-0.65 |
0 |
|
|
275971 |
103819582 |
1 |
NO2C12H17 |
AB2C12D17 |
-93.15 |
3.52 |
-9.43 |
-0.05 |
0 |
|
|
275972 |
103819583 |
1 |
BrN2O2C9H11 |
AB2C2D9E11 |
-69.81 |
1.79 |
-9.92 |
-1.14 |
0 |
|
|
275973 |
103819584 |
1 |
ClN3O4C9H10 |
AB3C4D9E10 |
-65.29 |
2.29 |
-10.45 |
-2.21 |
0 |
|
|
275974 |
103819592 |
1 |
BrNO2C17H24 |
ABC2D17E24 |
-100.49 |
4.44 |
-9.42 |
-0.14 |
0 |
|
|
275975 |
103819593 |
1 |
NO2C16H23 |
AB2C16D23 |
-98.14 |
5.4 |
-9.31 |
-0.02 |
0 |
|
|
275976 |
103819618 |
1 |
NF2O5C15H17 |
AB2C5D15E17 |
-304.79 |
3.57 |
-10.39 |
-1.59 |
0 |
|
|
275977 |
103819626 |
1 |
NSO5C15H21 |
ABC5D15E21 |
-226.91 |
7.32 |
-9.75 |
-1.36 |
0 |
|
|
275978 |
103819661 |
1 |
FNO5H16C18 |
ABC5D16E18 |
-209.71 |
2.26 |
-9.88 |
-0.75 |
0 |
|
|
275979 |
103819665 |
1 |
NCl2O5H15C18 |
AB2C5D15E18 |
-177.75 |
4.79 |
-9.89 |
-1.25 |
0 |
|
|
275980 |
103819669 |
1 |
NO6C19H19 |
AB6C19D19 |
-203.63 |
5.85 |
-9.48 |
-0.73 |
0 |
|
|
275981 |
103819698 |
1 |
NO5C23H23 |
AB5C23D23 |
-176.98 |
2.83 |
-9.1 |
-0.65 |
0 |
|
|
275982 |
103819699 |
1 |
NO5H21C25 |
AB5C21D25 |
-132.67 |
5.87 |
-8.95 |
-1.05 |
0 |
|
|
275983 |
103819718 |
1 |
NO5H25C27 |
AB5C25D27 |
-154.21 |
6.47 |
-9.03 |
-0.58 |
0 |
|
|
275984 |
103819732 |
1 |
NO6H19C23 |
AB6C19D23 |
-164.17 |
3.9 |
-8.94 |
-0.99 |
0 |
|
|
275985 |
103819736 |
1 |
NO5H21C22 |
AB5C21D22 |
-148.45 |
5.29 |
-8.96 |
-0.51 |
0 |
|
|
275986 |
103819747 |
1 |
NSO5H19C23 |
ABC5D19E23 |
-129.05 |
3.78 |
-8.93 |
-1.21 |
0 |
|
|
275987 |
103819748 |
1 |
NSO5H23C26 |
ABC5D23E26 |
-134.4 |
5.2 |
-8.84 |
-0.96 |
0 |
|
|
275988 |
103819758 |
2 |
NO2C12H14 |
AB2C12D14 |
-130.68 |
6.81 |
-8.84 |
-0.57 |
0 |
|
|
275989 |
103819766 |
1 |
N2O4C17H30 |
A2B4C17D30 |
-216.23 |
4.12 |
-8.86 |
0.32 |
0 |
|
|
275990 |
103819782 |
1 |
N2O4C27H32 |
A2B4C27D32 |
-140.16 |
4.19 |
-8.76 |
-0.42 |
0 |
|
|
275991 |
103819791 |
2 |
ON2C7H8 |
AB2C7D8 |
-13.84 |
8.76 |
-9.04 |
-0.96 |
0 |
|
|
275992 |
103819794 |
1 |
BrNO2C17H26 |
ABC2D17E26 |
-109.3 |
1.67 |
-9.55 |
-0.22 |
0 |
|
|
275993 |
103819796 |
1 |
BrN2O4C14H19 |
AB2C4D14E19 |
-90.75 |
4.66 |
-10.22 |
-1.94 |
0 |
|
|
275994 |
103819801 |
1 |
NO2C16H25 |
AB2C16D25 |
-105.6 |
2.65 |
-9.56 |
-0.04 |
0 |
|
|
275995 |
103819812 |
1 |
N3O4C13H15 |
A3B4C13D15 |
-147.22 |
2.61 |
-9.41 |
-0.8 |
0 |
|
|
275996 |
103819815 |
1 |
N2O3F4C12H12 |
A2B3C4D12E12 |
-311.55 |
1.58 |
-10.46 |
-1.28 |
0 |
|
|
275997 |
103819824 |
1 |
IN3O5C11H12 |
AB3C5D11E12 |
-87.7 |
1.83 |
-10.42 |
-2.0 |
0 |
|
|
275998 |
103819844 |
1 |
BrN3O3C10H12 |
AB3C3D10E12 |
-88.83 |
3.38 |
-10.22 |
-1.26 |
0 |
|
|
275999 |
103819845 |
1 |
O3N4C9H14 |
A3B4C9D14 |
-99.42 |
4.71 |
-9.93 |
-0.06 |
0 |
|
|
276000 |
103819848 |
1 |
ClO3N4C10H13 |
AB3C4D10E13 |
-104.04 |
1.52 |
-9.49 |
-0.82 |
0 |
|
|
276001 |
103819863 |
1 |
N4O5C12H16 |
A4B5C12D16 |
-120.17 |
7.79 |
-9.28 |
-1.1 |
0 |
|
|
276002 |
103819867 |
1 |
N2O5C12H16 |
A2B5C12D16 |
-192.3 |
4.57 |
-8.71 |
-0.89 |
0 |
|
|
276003 |
103819868 |
1 |
BrSN2O3C10H13 |
ABC2D3E10F13 |
-100.51 |
4.45 |
-9.56 |
-1.06 |
0 |
|
|
276004 |
103819872 |
1 |
BrN3O3C10H12 |
AB3C3D10E12 |
-103.96 |
7.18 |
-9.93 |
-0.93 |
0 |
|
|
276005 |
103819875 |
1 |
N3O3C13H15 |
A3B3C13D15 |
-86.3 |
4.75 |
-8.9 |
-0.55 |
0 |
|
|
276006 |
103819876 |
1 |
O3N5C7H11 |
A3B5C7D11 |
-64.32 |
2.4 |
-10.28 |
-0.72 |
0 |
|
|
276007 |
103819884 |
1 |
BrNSO2F3C13H15 |
ABCD2E3F13G15 |
-239.2 |
2.42 |
-8.77 |
-1.37 |
0 |
|
|
276008 |
103819888 |
1 |
BrNO2C16H24 |
ABC2D16E24 |
-107.56 |
1.47 |
-9.55 |
-0.22 |
0 |
|
|
276009 |
103819899 |
1 |
N3O3C12H25 |
A3B3C12D25 |
-182.86 |
4.73 |
-9.6 |
0.42 |
0 |
|
|
276010 |
103819906 |
1 |
N3O3C15H23 |
A3B3C15D23 |
-133.9 |
3.79 |
-9.9 |
-0.32 |
0 |
|
|
276011 |
103819911 |
1 |
N2O3C12H18 |
A2B3C12D18 |
-121.55 |
1.84 |
-9.82 |
-0.99 |
0 |
|
|
276012 |
103819913 |
1 |
NO3C17H21 |
AB3C17D21 |
-127.27 |
3.0 |
-8.7 |
-0.64 |
0 |
|
|
276013 |
103819917 |
1 |
NO2C11H21 |
AB2C11D21 |
-119.8 |
2.7 |
-9.67 |
1.18 |
0 |
|
|
276014 |
103819920 |
1 |
O2N3C10H17 |
A2B3C10D17 |
-65.94 |
6.92 |
-9.61 |
0.04 |
0 |
|
|
276015 |
103819956 |
1 |
BrON3C11H18 |
ABC3D11E18 |
-28.55 |
4.54 |
-8.83 |
-0.19 |
0 |
|
|
276016 |
103819978 |
1 |
NOSF4C12H15 |
ABCD4E12F15 |
-244.38 |
5.5 |
-8.82 |
-0.48 |
0 |
|
|
276017 |
103819981 |
1 |
OSN3C15H17 |
ABC3D15E17 |
19.37 |
4.65 |
-8.62 |
-1.0 |
0 |
|
|
276018 |
103819985 |
1 |
OSN3C9H15 |
ABC3D9E15 |
-13.45 |
2.13 |
-8.9 |
-0.35 |
0 |
|
|
276019 |
103819986 |
1 |
ClSO2N3C9H14 |
ABC2D3E9F14 |
-66.15 |
4.11 |
-9.01 |
-0.68 |
0 |
|
|
276020 |
103819994 |
1 |
OSN3C11H19 |
ABC3D11E19 |
-41.5 |
0.83 |
-8.88 |
0.11 |
0 |
|
|
276021 |
103819997 |
1 |
OSN4C11H20 |
ABC4D11E20 |
-23.82 |
4.64 |
-8.41 |
0.1 |
0 |
|
|
276022 |
103820011 |
1 |
SO2N3C11H17 |
AB2C3D11E17 |
-72.62 |
5.79 |
-8.7 |
-0.2 |
0 |
|
|
276023 |
103820015 |
1 |
S2N3O3C12H21 |
A2B3C3D12E21 |
-109.36 |
9.42 |
-9.03 |
-0.35 |
0 |
|
|
276024 |
103820018 |
1 |
OSN6C9H14 |
ABC6D9E14 |
60.95 |
6.8 |
-9.15 |
-1.24 |
0 |