List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
142834 |
53098597 |
1 |
O3N4C24H30 |
A3B4C24D30 |
-83.88 |
5.62 |
-8.28 |
0.08 |
0 |
|
|
142835 |
53098598 |
1 |
BrO2N4C22H25 |
AB2C4D22E25 |
-34.72 |
7.23 |
-8.85 |
-0.07 |
0 |
|
|
142836 |
53098599 |
1 |
ClO2N4C23H27 |
AB2C4D23E27 |
-57.52 |
6.96 |
-8.54 |
0.01 |
0 |
|
|
142837 |
53098600 |
1 |
BrFO2N4C22H24 |
ABC2D4E22F24 |
-81.22 |
4.37 |
-9.03 |
-0.5 |
0 |
|
|
142838 |
53098601 |
1 |
O2N4C23H28 |
A2B4C23D28 |
-50.92 |
3.91 |
-8.9 |
0.06 |
0 |
|
|
142839 |
53098612 |
2 |
N2O2C12H15 |
A2B2C12D15 |
-125.36 |
3.28 |
-8.85 |
-0.05 |
0 |
|
|
142840 |
53098625 |
1 |
SO2N4C23H28 |
AB2C4D23E28 |
-39.76 |
6.56 |
-8.27 |
0.01 |
0 |
|
|
142841 |
53098693 |
2 |
ON2C11H17 |
AB2C11D17 |
-99.69 |
3.67 |
-9.34 |
0.15 |
0 |
|
|
142842 |
53098750 |
1 |
ClON4H21C22 |
ABC4D21E22 |
44.22 |
7.43 |
-8.56 |
-0.62 |
0 |
|
|
142843 |
53098751 |
1 |
FON4H21C22 |
ABC4D21E22 |
5.88 |
7.78 |
-8.59 |
-0.71 |
0 |
|
|
142844 |
53099457 |
1 |
N3O3C26H27 |
A3B3C26D27 |
-67.48 |
7.86 |
-8.18 |
-0.26 |
0 |
|
|
142845 |
53099795 |
1 |
FO2S2N4H11C15 |
AB2C2D4E11F15 |
-14.33 |
3.16 |
-9.25 |
-1.89 |
0 |
|
|
142846 |
53099835 |
1 |
ClSN4O4H19C20 |
ABC4D4E19F20 |
-67.61 |
1.65 |
-8.5 |
-1.96 |
0 |
|
|
142847 |
53100080 |
1 |
SO3N5C20H21 |
AB3C5D20E21 |
-30.38 |
1.19 |
-8.53 |
-1.72 |
0 |
|
|
142848 |
53100585 |
1 |
O2N5H17C20 |
A2B5C17D20 |
34.46 |
4.65 |
-8.48 |
-1.17 |
0 |
|
|
142849 |
53100586 |
1 |
O2N5H15C19 |
A2B5C15D19 |
44.12 |
5.29 |
-8.68 |
-1.22 |
0 |
|
|
142850 |
53100954 |
1 |
N4O5H24C27 |
A4B5C24D27 |
-57.07 |
4.12 |
-8.58 |
-0.92 |
0 |
|
|
142851 |
53102316 |
1 |
ClON5C27H32 |
ABC5D27E32 |
21.79 |
6.43 |
-8.34 |
-0.96 |
0 |
|
|
142852 |
53102479 |
1 |
SN2O6C25H26 |
AB2C6D25E26 |
-156.54 |
9.53 |
-8.57 |
-0.31 |
0 |
|
|
142853 |
53103257 |
1 |
N3O4H23C24 |
A3B4C23D24 |
-27.49 |
3.65 |
-8.93 |
-0.7 |
0 |
|
|
142854 |
53103532 |
1 |
N3O3C30H31 |
A3B3C30D31 |
-61.69 |
3.28 |
-8.71 |
-0.98 |
0 |
|
|
142855 |
53103664 |
1 |
SO2N3C28H33 |
AB2C3D28E33 |
-40.36 |
4.98 |
-9.19 |
-1.08 |
0 |
|
|
142856 |
53104167 |
1 |
O2N5C21H31 |
A2B5C21D31 |
-69.81 |
7.74 |
-9.04 |
-0.37 |
0 |
|
|
142857 |
53104187 |
1 |
ClO3N5C22H26 |
AB3C5D22E26 |
-68.88 |
4.03 |
-8.76 |
-0.48 |
0 |
|
|
142858 |
53104206 |
1 |
FO2N5C21H24 |
AB2C5D21E24 |
-65.69 |
4.43 |
-8.86 |
-0.69 |
0 |
|
|
142859 |
53104235 |
1 |
ClO2N5C21H24 |
AB2C5D21E24 |
-33.29 |
6.16 |
-8.95 |
-0.5 |
0 |
|
|
142860 |
53104646 |
1 |
FSO3N4C21H21 |
ABC3D4E21F21 |
-69.57 |
4.43 |
-8.7 |
-1.06 |
0 |
|
|
142861 |
53105084 |
1 |
SN3O4C23H23 |
AB3C4D23E23 |
-80.98 |
6.12 |
-9.18 |
-1.29 |
0 |
|
|
142862 |
53105085 |
1 |
SN2O4C25H30 |
AB2C4D25E30 |
-131.84 |
3.8 |
-8.59 |
-1.09 |
0 |
|
|
142863 |
53105141 |
1 |
SN2O4C23H32 |
AB2C4D23E32 |
-159.56 |
6.07 |
-8.99 |
-0.9 |
0 |
|
|
142864 |
53105194 |
1 |
SN2O5C21H30 |
AB2C5D21E30 |
-196.73 |
3.75 |
-9.0 |
-0.86 |
0 |
|
|
142865 |
53105441 |
1 |
FSN4O4C23H23 |
ABC4D4E23F23 |
-126.28 |
5.78 |
-8.76 |
-1.28 |
0 |
|
|
142866 |
53105525 |
1 |
ClSN2O3C19H21 |
ABC2D3E19F21 |
-108.44 |
7.68 |
-9.3 |
-0.71 |
0 |
|
|
142867 |
53105622 |
1 |
SN2O4C21H26 |
AB2C4D21E26 |
-139.33 |
7.58 |
-8.78 |
-0.51 |
0 |
|
|
142868 |
53106203 |
1 |
FS2N3O4C21H22 |
AB2C3D4E21F22 |
-171.75 |
6.48 |
-9.27 |
-0.96 |
0 |
|
|
142869 |
53106245 |
1 |
S2N3O5C23H27 |
A2B3C5D23E27 |
-170.75 |
6.42 |
-8.56 |
-0.98 |
0 |
|
|
142870 |
53106246 |
1 |
S2N3O4C23H27 |
A2B3C4D23E27 |
-127.05 |
6.77 |
-8.92 |
-0.88 |
0 |
|
|
142871 |
53106247 |
1 |
S2N3O4C22H25 |
A2B3C4D22E25 |
-132.38 |
5.82 |
-8.76 |
-0.96 |
0 |
|
|
142872 |
53106248 |
1 |
S2N3O4C22H25 |
A2B3C4D22E25 |
-125.61 |
7.04 |
-9.19 |
-0.92 |
0 |
|
|
142873 |
53106249 |
2 |
SN2O2C10H11 |
AB2C2D10E11 |
-107.1 |
6.89 |
-9.17 |
-0.91 |
0 |
|
|
142874 |
53106250 |
1 |
S2N3O4C22H25 |
A2B3C4D22E25 |
-139.51 |
3.94 |
-8.84 |
-1.03 |
0 |
|
|
142875 |
53106251 |
1 |
S2N3O5C22H25 |
A2B3C5D22E25 |
-167.3 |
2.97 |
-8.56 |
-0.95 |
0 |
|
|
142876 |
53106252 |
1 |
S2N3O4C21H23 |
A2B3C4D21E23 |
-122.91 |
5.33 |
-9.05 |
-0.99 |
0 |
|
|
142877 |
53106537 |
1 |
ClSN4O5H19C21 |
ABC4D5E19F21 |
-58.17 |
4.18 |
-9.4 |
-1.25 |
0 |
|
|
142878 |
53106538 |
1 |
ClSN4O5C19H21 |
ABC4D5E19F21 |
-95.19 |
5.09 |
-9.3 |
-1.15 |
0 |
|
|
142879 |
53106539 |
1 |
ClSN4O5H19C21 |
ABC4D5E19F21 |
-68.07 |
4.44 |
-8.75 |
-1.34 |
0 |
|
|
142880 |
53106601 |
1 |
SN4O5C22H24 |
AB4C5D22E24 |
-102.01 |
7.38 |
-9.23 |
-0.96 |
0 |
|
|
142881 |
53107573 |
1 |
O3N4C25H36 |
A3B4C25D36 |
-136.68 |
5.83 |
-9.62 |
-0.37 |
0 |
|
|
142882 |
53108089 |
1 |
SO3N4C21H26 |
AB3C4D21E26 |
-50.1 |
4.62 |
-8.41 |
-1.18 |
0 |
|
|
142883 |
53108090 |
1 |
O3N4H22C23 |
A3B4C22D23 |
-13.06 |
4.94 |
-8.92 |
-1.09 |
0 |
|
|
142884 |
53108488 |
1 |
O3N5C23H31 |
A3B5C23D31 |
-71.15 |
4.92 |
-8.39 |
-0.45 |
0 |
|
|
142885 |
53108489 |
1 |
N5O5C26H33 |
A5B5C26D33 |
-159.32 |
9.5 |
-8.5 |
-0.82 |
0 |
|
|
142886 |
53108753 |
1 |
ON6C23H32 |
AB6C23D32 |
12.41 |
6.22 |
-8.41 |
-0.38 |
0 |
|
|
142887 |
53109449 |
1 |
OSN3H27C28 |
ABC3D27E28 |
38.37 |
3.87 |
-8.57 |
-0.63 |
0 |
|
|
142888 |
53109509 |
1 |
ClSO2N3H26C27 |
ABC2D3E26F27 |
-11.07 |
5.84 |
-8.65 |
-0.76 |
0 |
|
|
142889 |
53109549 |
1 |
FSO2N3H24C26 |
ABC2D3E24F26 |
-42.63 |
5.85 |
-8.68 |
-0.84 |
0 |
|
|
142890 |
53110003 |
1 |
N3O4C25H27 |
A3B4C25D27 |
-64.85 |
6.51 |
-8.56 |
-0.68 |
0 |
|
|
142891 |
53110004 |
1 |
N3O4C23H23 |
A3B4C23D23 |
-56.71 |
6.06 |
-8.6 |
-0.63 |
0 |
|
|
142892 |
53110255 |
1 |
BrN3O4C22H22 |
AB3C4D22E22 |
-56.0 |
5.28 |
-8.68 |
-0.86 |
0 |
|
|
142893 |
53110354 |
1 |
N2O2C19H26 |
A2B2C19D26 |
-78.88 |
4.35 |
-8.83 |
-0.11 |
0 |
|
|
142894 |
53110500 |
1 |
SN3O3C20H31 |
AB3C3D20E31 |
-126.56 |
5.82 |
-8.65 |
-0.01 |
0 |
|
|
142895 |
53110655 |
1 |
N2O2C17H20 |
A2B2C17D20 |
-42.62 |
7.14 |
-9.03 |
-0.68 |
0 |
|
|
142896 |
53110656 |
2 |
NOC10H12 |
ABC10D12 |
-49.45 |
6.54 |
-8.95 |
-0.65 |
0 |
|
|
142897 |
53110657 |
1 |
SN2O2H20C21 |
AB2C2D20E21 |
-2.41 |
5.6 |
-8.47 |
-0.67 |
0 |
|
|
142898 |
53111164 |
1 |
O2N4C23H28 |
A2B4C23D28 |
-6.75 |
5.72 |
-9.18 |
-0.75 |
0 |
|
|
142899 |
53111204 |
2 |
ON2C12H12 |
AB2C12D12 |
28.21 |
5.36 |
-8.64 |
-0.88 |
0 |
|
|
142900 |
53111271 |
1 |
ON4H22C23 |
AB4C22D23 |
61.53 |
3.7 |
-8.49 |
-0.86 |
0 |
|
|
142901 |
53112180 |
1 |
ClO2N3H18C23 |
AB2C3D18E23 |
16.75 |
3.03 |
-9.14 |
-1.2 |
0 |
|
|
142902 |
53112181 |
1 |
ClO2N3H18C23 |
AB2C3D18E23 |
15.4 |
3.83 |
-8.96 |
-1.17 |
0 |
|
|
142903 |
53112326 |
1 |
ClN2S2O4C18H21 |
AB2C2D4E18F21 |
-123.64 |
7.99 |
-9.04 |
-1.09 |
0 |
|
|
142904 |
53112368 |
1 |
BrN2S2O3C18H21 |
AB2C2D3E18F21 |
-79.31 |
7.13 |
-9.51 |
-1.06 |
0 |
|
|
142905 |
53112776 |
1 |
N3S3O4C19H21 |
A3B3C4D19E21 |
-115.04 |
5.57 |
-9.22 |
-1.22 |
0 |
|
|
142906 |
53112777 |
1 |
S2N4O5C17H22 |
A2B4C5D17E22 |
-188.93 |
4.44 |
-9.44 |
-1.13 |
0 |
|
|
142907 |
53112937 |
2 |
NO2C9H10 |
AB2C9D10 |
-127.12 |
3.74 |
-9.49 |
-1.07 |
0 |
|
|
142908 |
53112938 |
1 |
N2O5H18C20 |
A2B5C18D20 |
-123.15 |
3.26 |
-8.51 |
-1.1 |
0 |
|
|
142909 |
53112939 |
1 |
FN2O4H15C19 |
AB2C4D15E19 |
-130.58 |
5.04 |
-9.2 |
-1.2 |
0 |
|
|
142910 |
53113021 |
2 |
NO3C11H11 |
AB3C11D11 |
-169.0 |
4.23 |
-8.56 |
-1.09 |
0 |
|
|
142911 |
53113481 |
1 |
FN2O4H17C24 |
AB2C4D17E24 |
-94.01 |
4.05 |
-8.53 |
-0.81 |
0 |
|
|
142912 |
53113482 |
1 |
F2N2O2H16C23 |
A2B2C2D16E23 |
-77.91 |
2.24 |
-8.58 |
-0.81 |
0 |
|
|
142913 |
53113952 |
1 |
FSN3O3C20H20 |
ABC3D3E20F20 |
-107.45 |
7.0 |
-9.16 |
-0.83 |
0 |
|
|
142914 |
53114392 |
1 |
SO4N5C18H25 |
AB4C5D18E25 |
-74.28 |
12.69 |
-9.18 |
-1.48 |
0 |
|
|
142915 |
53114395 |
1 |
SO4N5C17H23 |
AB4C5D17E23 |
-63.35 |
9.0 |
-9.08 |
-1.48 |
0 |
|
|
142916 |
53115073 |
1 |
ON4C14H16 |
AB4C14D16 |
44.86 |
5.09 |
-9.4 |
-0.86 |
0 |
|
|
142917 |
53115074 |
1 |
FON4C13H13 |
ABC4D13E13 |
-3.9 |
2.61 |
-9.29 |
-1.23 |
0 |
|
|
142918 |
53115395 |
1 |
FSN4O4C19H19 |
ABC4D4E19F19 |
-123.86 |
5.84 |
-8.54 |
-0.37 |
0 |
|
|
142919 |
53116376 |
1 |
O3N6C22H26 |
A3B6C22D26 |
-65.8 |
1.11 |
-8.79 |
-1.47 |
0 |
|
|
142920 |
53116377 |
1 |
O4N5C20H21 |
A4B5C20D21 |
-102.74 |
2.25 |
-9.51 |
-1.54 |
0 |
|
|
142921 |
53116378 |
1 |
O3N5C21H23 |
A3B5C21D23 |
-74.86 |
2.54 |
-9.52 |
-1.44 |
0 |
|
|
142922 |
53116402 |
3 |
ON2C8H10 |
AB2C8D10 |
-81.67 |
1.01 |
-8.88 |
-1.43 |
0 |
|
|
142923 |
53116403 |
1 |
O3N5C19H21 |
A3B5C19D21 |
-78.5 |
5.41 |
-9.8 |
-1.73 |
0 |
|
|
142924 |
53116404 |
1 |
O3N5C25H25 |
A3B5C25D25 |
-49.9 |
2.18 |
-9.44 |
-1.49 |
0 |
|
|
142925 |
53116697 |
1 |
N3O5C29H29 |
A3B5C29D29 |
-83.92 |
2.04 |
-8.27 |
-0.96 |
0 |
|
|
142926 |
53117561 |
1 |
FSN2O3C23H29 |
ABC2D3E23F29 |
-165.72 |
8.35 |
-9.31 |
-0.25 |
0 |
|
|
142927 |
53117562 |
1 |
FSN2O3C15H21 |
ABC2D3E15F21 |
-170.81 |
4.21 |
-9.57 |
-0.28 |
0 |
|
|
142928 |
53117563 |
1 |
FSN2O4C21H25 |
ABC2D4E21F25 |
-175.93 |
9.12 |
-9.44 |
-0.47 |
0 |
|
|
142929 |
53118242 |
1 |
ClO2N4H17C19 |
AB2C4D17E19 |
-14.5 |
5.7 |
-8.99 |
-1.19 |
0 |
|
|
142930 |
53118391 |
1 |
O2N3H17C19 |
A2B3C17D19 |
-1.88 |
5.12 |
-8.77 |
-0.84 |
0 |
|
|
142931 |
53118392 |
2 |
ON2H8C9 |
AB2C8D9 |
7.9 |
2.73 |
-8.74 |
-1.05 |
0 |
|
|
142932 |
53118732 |
1 |
ClSN3O4C20H26 |
ABC3D4E20F26 |
-127.92 |
3.28 |
-9.57 |
-0.42 |
0 |
|
|
142933 |
53118750 |
1 |
SN3O4C18H31 |
AB3C4D18E31 |
-164.79 |
1.64 |
-9.59 |
-0.46 |
0 |