List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
229993 |
87569836 |
2 |
O2C14H27 |
A2B14C27 |
-285.07 |
5.81 |
-10.33 |
0.57 |
0 |
|
|
229994 |
87569837 |
2 |
O2C18H35 |
A2B18C35 |
-340.63 |
0.56 |
-10.61 |
0.84 |
0 |
|
|
229995 |
87569841 |
2 |
O6C23H26 |
A6B23C26 |
-237.06 |
4.78 |
-8.59 |
0.1 |
0 |
|
|
229996 |
87569842 |
1 |
NO7C29H33 |
AB7C29D33 |
-179.78 |
4.56 |
-8.62 |
-0.46 |
0 |
|
|
229997 |
87569844 |
1 |
NO7C29H33 |
AB7C29D33 |
-210.54 |
2.61 |
-8.37 |
-0.35 |
0 |
|
|
229998 |
87569846 |
1 |
CSZnH4O5 |
ABCD4E5 |
-171.03 |
13.8 |
-10.82 |
-2.98 |
0 |
|
|
229999 |
87569849 |
1 |
PC2Cl2O2H5 |
AB2C2D2E5 |
-114.62 |
1.7 |
-10.76 |
0.05 |
0 |
|
|
230000 |
87569850 |
1 |
AsClON5H13C19 |
ABCD5E13F19 |
156.3 |
3.53 |
-7.96 |
-1.99 |
0 |
|
|
230001 |
87569851 |
1 |
OSC7H14 |
ABC7D14 |
-44.21 |
4.79 |
-8.87 |
-0.61 |
0 |
|
|
230002 |
87569853 |
1 |
N3O4C23H35 |
A3B4C23D35 |
-170.55 |
1.32 |
-8.98 |
-0.11 |
0 |
|
|
230003 |
87569855 |
2 |
BrNH4C6 |
ABC4D6 |
53.56 |
2.6 |
-8.77 |
-1.67 |
0 |
|
|
230004 |
87569857 |
1 |
BrO2N5H18C23 |
AB2C5D18E23 |
53.36 |
3.06 |
-9.34 |
-0.89 |
0 |
|
|
230005 |
87569860 |
1 |
OSC6H12 |
ABC6D12 |
-39.64 |
4.73 |
-8.86 |
-0.6 |
0 |
|
|
230006 |
87569861 |
1 |
NSiO3C11H25 |
ABC3D11E25 |
-219.34 |
4.31 |
-8.96 |
0.74 |
0 |
|
|
230007 |
87569863 |
1 |
ClNO5C18H22 |
ABC5D18E22 |
-160.68 |
6.48 |
-8.84 |
-0.11 |
0 |
|
|
230008 |
87569865 |
1 |
SN2O6H22C23 |
AB2C6D22E23 |
-133.11 |
4.89 |
-9.0 |
-1.3 |
0 |
|
|
230009 |
87569868 |
1 |
OSN3C6H11 |
ABC3D6E11 |
5.9 |
3.01 |
-9.31 |
-0.36 |
0 |
|
|
230010 |
87569869 |
1 |
O4C15H28 |
A4B15C28 |
-214.25 |
2.2 |
-10.82 |
-0.25 |
0 |
|
|
230011 |
87569870 |
1 |
S2O5C18H26 |
A2B5C18D26 |
-213.19 |
3.83 |
-8.35 |
0.34 |
0 |
|
|
230012 |
87569871 |
1 |
ClO3N6C30H41 |
AB3C6D30E41 |
-120.59 |
6.5 |
-9.02 |
-0.76 |
0 |
|
|
230013 |
87569874 |
2 |
O4C7H9 |
A4B7C9 |
-288.65 |
3.3 |
-9.38 |
-1.2 |
0 |
|
|
230014 |
87569875 |
4 |
O3C10H12 |
A3B10C12 |
-247.16 |
6.37 |
-8.65 |
-0.06 |
0 |
|
|
230015 |
87569876 |
2 |
O3C11H12 |
A3B11C12 |
-232.99 |
0.94 |
-8.33 |
-0.14 |
0 |
|
|
230016 |
87569878 |
1 |
ClO3F4N9H18C24 |
AB3C4D9E18F24 |
-108.01 |
3.58 |
-9.05 |
-1.77 |
0 |
|
|
230017 |
87569879 |
1 |
SiN4C16H16 |
AB4C16D16 |
130.08 |
2.6 |
-9.07 |
-0.94 |
0 |
|
|
230018 |
87569880 |
1 |
SO2N6C23H34 |
AB2C6D23E34 |
-2.26 |
5.58 |
-8.32 |
-0.92 |
0 |
|
|
230019 |
87569882 |
2 |
O3C11H12 |
A3B11C12 |
-229.7 |
4.78 |
-8.66 |
-0.41 |
0 |
|
|
230022 |
87569886 |
1 |
S2F3O5C13H13 |
A2B3C5D13E13 |
-327.45 |
11.46 |
-9.33 |
-1.48 |
0 |
|
|
230023 |
87569887 |
2 |
O3C11H12 |
A3B11C12 |
-233.01 |
1.37 |
-8.59 |
-0.28 |
0 |
|
|
230024 |
87569888 |
1 |
ON3C18H29 |
AB3C18D29 |
-47.93 |
2.42 |
-8.29 |
1.06 |
0 |
|
|
230025 |
87569889 |
1 |
FNO3C6H10 |
ABC3D6E10 |
-182.53 |
4.56 |
-10.24 |
-0.05 |
0 |
|
|
230026 |
87569891 |
1 |
SN3O12C16H31 |
AB3C12D16E31 |
-576.31 |
3.65 |
-9.68 |
-0.4 |
0 |
|
|
230027 |
87569892 |
1 |
N3O6C31H49 |
A3B6C31D49 |
-215.31 |
6.35 |
-8.18 |
-0.76 |
0 |
|
|
230029 |
87569895 |
2 |
NO2C8H9 |
AB2C8D9 |
-87.99 |
6.44 |
-9.45 |
-0.74 |
0 |
|
|
230030 |
87569896 |
1 |
ClS2O3N6C25H37 |
AB2C3D6E25F37 |
-88.37 |
8.87 |
-8.8 |
-0.94 |
0 |
|
|
230031 |
87569898 |
1 |
O4C19H36 |
A4B19C36 |
-253.73 |
0.61 |
-10.72 |
0.79 |
0 |
|
|
230032 |
87569899 |
1 |
ON3C24H33 |
AB3C24D33 |
-17.71 |
6.24 |
-8.53 |
0.32 |
0 |
|
|
230033 |
87569900 |
1 |
F2N2O4H20C21 |
A2B2C4D20E21 |
-115.65 |
2.27 |
-9.19 |
-0.48 |
0 |
|
|
230034 |
87569901 |
1 |
FOSN2C17H21 |
ABCD2E17F21 |
-46.91 |
1.53 |
-8.72 |
-0.67 |
0 |
|
|
230035 |
87569902 |
1 |
BCl2O3C7H15 |
AB2C3D7E15 |
-250.48 |
2.55 |
-10.29 |
0.27 |
-1 |
|
|
230036 |
87569909 |
1 |
NSO4C7H10 |
ABC4D7E10 |
-162.81 |
2.52 |
0.0 |
0.0 |
1 |
|
|
230037 |
87569910 |
1 |
NSO4C7H12 |
ABC4D7E12 |
-152.2 |
6.76 |
0.0 |
0.0 |
0 |
|
|
230038 |
87569911 |
1 |
FO4N7C16H18 |
AB4C7D16E18 |
-96.95 |
8.25 |
-8.82 |
-1.16 |
0 |
|
|
230039 |
87569916 |
1 |
ClN3O4C34H34 |
AB3C4D34E34 |
-52.01 |
5.29 |
-8.91 |
-0.62 |
0 |
|
|
230040 |
87569918 |
1 |
ClSF2O2N4C24H31 |
ABC2D2E4F24G31 |
-153.53 |
3.96 |
-8.88 |
-0.79 |
0 |
|
|
230041 |
87569922 |
1 |
Cl2N2O4H20C21 |
A2B2C4D20E21 |
-33.91 |
4.21 |
-9.28 |
-0.57 |
0 |
|
|
230042 |
87569927 |
1 |
FN4O4H17C18 |
AB4C4D17E18 |
-96.96 |
5.26 |
-9.42 |
-1.33 |
0 |
|
|
230043 |
87569928 |
2 |
O2C6H11 |
A2B6C11 |
-167.33 |
2.34 |
-10.02 |
0.41 |
0 |
|
|
230044 |
87569938 |
1 |
SN2O9C19H26 |
AB2C9D19E26 |
-358.19 |
5.0 |
-10.91 |
-1.86 |
0 |
|
|
230045 |
87569939 |
1 |
NSO6C27H31 |
ABC6D27E31 |
-176.3 |
2.83 |
-8.85 |
-0.76 |
0 |