List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
397903 |
135030936 |
1 |
SO4C11H12 |
AB4C11D12 |
-106.66 |
4.25 |
-8.9 |
-1.13 |
0 |
|
|
397904 |
135030941 |
1 |
NO2C7H13 |
AB2C7D13 |
-83.46 |
2.78 |
-9.28 |
0.48 |
0 |
|
|
397905 |
135030942 |
1 |
O3C11H18 |
A3B11C18 |
-140.3 |
4.59 |
-9.13 |
0.59 |
0 |
|
|
397906 |
135030943 |
1 |
NO9C31H45 |
AB9C31D45 |
-369.5 |
9.99 |
-9.23 |
-0.22 |
0 |
|
|
397907 |
135030944 |
1 |
NSiO4C21H39 |
ABC4D21E39 |
-231.6 |
2.85 |
-8.99 |
0.03 |
0 |
|
|
397908 |
135030946 |
1 |
Br2O4C9H10 |
A2B4C9D10 |
-111.29 |
3.24 |
-9.24 |
-1.53 |
0 |
|
|
397909 |
135030948 |
1 |
BrO4C17H17 |
AB4C17D17 |
-126.95 |
4.89 |
-9.85 |
-0.51 |
0 |
|
|
397910 |
135030949 |
1 |
ON3C20H25 |
AB3C20D25 |
21.54 |
3.61 |
-8.59 |
-0.56 |
0 |
|
|
397911 |
135030951 |
1 |
Cl3O3C11H13 |
A3B3C11D13 |
-135.15 |
4.45 |
-10.53 |
-0.68 |
0 |
|
|
397912 |
135030952 |
1 |
OSF5H7C10 |
ABC5D7E10 |
-209.61 |
5.08 |
-10.32 |
-1.06 |
0 |
|
|
397914 |
135030960 |
1 |
BrON3H16C22 |
ABC3D16E22 |
101.81 |
9.02 |
-9.29 |
-0.88 |
0 |
|
|
397915 |
135030961 |
1 |
FNO4C12H14 |
ABC4D12E14 |
-197.37 |
3.03 |
-10.28 |
-0.79 |
0 |
|
|
397916 |
135030966 |
2 |
FNOC8H11 |
ABCD8E11 |
-166.48 |
3.6 |
-8.78 |
0.24 |
0 |
|
|
397917 |
135030978 |
1 |
S2O3C19H34 |
A2B3C19D34 |
-183.12 |
1.66 |
-8.53 |
0.29 |
0 |
|
|
397918 |
135030980 |
4 |
OC4H7 |
AB4C7 |
-213.57 |
4.18 |
-9.51 |
0.43 |
0 |
|
|
397919 |
135030982 |
1 |
O5N6C22H23 |
A5B6C22D23 |
-101.54 |
9.55 |
0.0 |
0.0 |
0 |
|
|
397920 |
135030986 |
1 |
O2H13C15 |
A2B13C15 |
-3.69 |
4.2 |
0.0 |
0.0 |
0 |
|
|
397921 |
135030990 |
1 |
SSiF3O5C15H21 |
ABC3D5E15F21 |
-381.46 |
2.0 |
-9.29 |
-1.35 |
0 |
|
|
397922 |
135030991 |
1 |
NSO4C24H25 |
ABC4D24E25 |
-107.51 |
7.14 |
-9.22 |
-0.37 |
0 |
|
|
397923 |
135030992 |
1 |
S2O3C16H16 |
A2B3C16D16 |
-55.29 |
6.09 |
-8.84 |
-0.5 |
0 |
|
|
397924 |
135030995 |
1 |
ClNO2C13H18 |
ABC2D13E18 |
-93.99 |
2.86 |
-9.74 |
0.19 |
0 |
|
|
397925 |
135031005 |
2 |
NO2C7H8 |
AB2C7D8 |
-56.75 |
3.9 |
-9.86 |
-0.93 |
0 |
|
|
397926 |
135031009 |
1 |
NSO2F3C19H20 |
ABC2D3E19F20 |
-229.67 |
7.05 |
-8.56 |
-0.68 |
0 |
|
|
397927 |
135031013 |
1 |
NSF3O3C18H18 |
ABC3D3E18F18 |
-247.97 |
5.33 |
-8.29 |
-0.67 |
0 |
|
|
397928 |
135031020 |
1 |
NO3H21C30 |
AB3C21D30 |
5.75 |
8.67 |
-8.53 |
-1.17 |
0 |
|
|
397929 |
135031028 |
1 |
O3C16H18 |
A3B16C18 |
-75.19 |
2.45 |
-8.85 |
-1.03 |
0 |
|
|
397930 |
135031030 |
1 |
NSO5H17C19 |
ABC5D17E19 |
-75.52 |
5.0 |
-8.54 |
-1.31 |
0 |
|
|
397931 |
135031041 |
1 |
N2O3H14C18 |
A2B3C14D18 |
-34.61 |
5.32 |
-9.21 |
-0.71 |
0 |
|
|
397932 |
135031049 |
1 |
ClO2N5C10H12 |
AB2C5D10E12 |
-21.45 |
3.93 |
-9.46 |
-0.89 |
0 |
|
|
397933 |
135031055 |
1 |
N2O6H8C15 |
A2B6C8D15 |
-21.44 |
6.28 |
-10.27 |
-1.94 |
0 |
|
|
397934 |
135031056 |
1 |
ClNO4H8C15 |
ABC4D8E15 |
-25.77 |
4.45 |
-9.58 |
-1.68 |
0 |
|
|
397935 |
135031063 |
1 |
OPH17C22 |
ABC17D22 |
60.93 |
5.76 |
-8.49 |
-1.13 |
0 |
|
|
397936 |
135031065 |
1 |
NO2C15H21 |
AB2C15D21 |
-61.48 |
1.95 |
-9.34 |
0.21 |
0 |
|
|
397937 |
135031068 |
1 |
NSiO4C22H41 |
ABC4D22E41 |
-243.7 |
3.12 |
-8.89 |
-0.15 |
0 |
|
|
397938 |
135031072 |
1 |
NF2C13H13 |
AB2C13D13 |
-60.16 |
4.22 |
-9.58 |
-0.78 |
0 |
|
|
397939 |
135031079 |
2 |
OH6C9 |
AB6C9 |
-10.16 |
1.53 |
-8.24 |
-1.01 |
0 |
|
|
397940 |
135031094 |
1 |
NO2H13C18 |
AB2C13D18 |
-14.2 |
3.85 |
-9.11 |
-0.83 |
0 |
|
|
397941 |
135031097 |
1 |
SSiF3O4C10H13 |
ABC3D4E10F13 |
-324.2 |
3.94 |
-9.2 |
-1.25 |
0 |
|
|
397942 |
135031113 |
1 |
Br2O3C8H8 |
A2B3C8D8 |
-82.34 |
2.17 |
-8.86 |
-0.69 |
0 |
|
|
397943 |
135031115 |
1 |
NSiO4C11H23 |
ABC4D11E23 |
-234.66 |
3.51 |
-9.79 |
0.26 |
0 |
|
|
397944 |
135031116 |
1 |
O6C13H18 |
A6B13C18 |
-240.11 |
3.94 |
-9.97 |
0.16 |
0 |
|
|
397945 |
135031117 |
3 |
ClO2C4H5 |
AB2C4D5 |
-284.75 |
3.05 |
-10.67 |
-0.48 |
0 |
|
|
397946 |
135031118 |
2 |
O3C10H16 |
A3B10C16 |
-295.93 |
3.57 |
-9.79 |
0.28 |
0 |
|
|
397947 |
135031119 |
1 |
NSiO2C19H41 |
ABC2D19E41 |
-211.97 |
4.41 |
-8.69 |
1.43 |
0 |
|
|
397948 |
135031120 |
1 |
NOSiC19H39 |
ABCD19E39 |
-152.35 |
2.54 |
-8.37 |
1.49 |
0 |
|
|
397949 |
135031121 |
1 |
BrNH14C17 |
ABC14D17 |
60.13 |
1.05 |
-9.13 |
-0.97 |
0 |
|
|
397950 |
135031123 |
1 |
OH24C25 |
AB24C25 |
24.36 |
0.46 |
-8.35 |
-0.48 |
0 |
|
|
397951 |
135031124 |
1 |
NPSiO4C36H46 |
ABCD4E36F46 |
-188.87 |
11.21 |
-8.43 |
-0.74 |
0 |
|
|
397952 |
135031125 |
1 |
SO2N3H19C23 |
AB2C3D19E23 |
71.37 |
6.64 |
-8.62 |
-0.92 |
0 |
|
|
397953 |
135031127 |
2 |
OC9H10 |
AB9C10 |
-53.3 |
2.96 |
-9.45 |
-0.02 |
0 |