List Systems
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Record Count: 438090
|
Id
|
Cidd
|
Fcv
|
Redu
|
Stoi
|
Heat Of Formation
|
Dipole
|
Homo
|
Lumo
|
Charge
|
|
|
122862 |
50824673 |
1 |
SN4O5C20H24 |
AB4C5D20E24 |
-106.13 |
4.48 |
-9.23 |
-0.85 |
0 |
|
|
122863 |
50824678 |
1 |
ClFSN4O5H14C18 |
ABCD4E5F14G18 |
-131.69 |
4.12 |
-9.2 |
-1.13 |
0 |
|
|
122864 |
50824972 |
1 |
ClSN4O4C17H19 |
ABC4D4E17F19 |
-99.76 |
6.74 |
-9.21 |
-1.33 |
0 |
|
|
122865 |
50824973 |
1 |
SN4O5C23H24 |
AB4C5D23E24 |
-111.44 |
3.2 |
-8.63 |
-1.24 |
0 |
|
|
122866 |
50824998 |
1 |
SN4O5C23H24 |
AB4C5D23E24 |
-114.25 |
8.13 |
-8.2 |
-1.28 |
0 |
|
|
122867 |
50824999 |
1 |
ClSN4O4C23H23 |
ABC4D4E23F23 |
-92.99 |
1.7 |
-8.79 |
-1.09 |
0 |
|
|
122868 |
50825000 |
1 |
SN4O4C24H26 |
AB4C4D24E26 |
-92.47 |
4.02 |
-8.63 |
-1.23 |
0 |
|
|
122869 |
50825001 |
1 |
SN4O4C23H24 |
AB4C4D23E24 |
-83.74 |
5.65 |
-8.7 |
-1.2 |
0 |
|
|
122870 |
50825002 |
1 |
SN4O4C23H24 |
AB4C4D23E24 |
-73.81 |
6.31 |
-9.0 |
-1.22 |
0 |
|
|
122871 |
50825003 |
1 |
SN4O5C24H24 |
AB4C5D24E24 |
-104.67 |
4.04 |
-8.36 |
-1.24 |
0 |
|
|
122872 |
50825004 |
1 |
SN4O5C17H20 |
AB4C5D17E20 |
-130.59 |
3.7 |
-8.95 |
-1.23 |
0 |
|
|
122873 |
50825005 |
1 |
SN4O6C22H24 |
AB4C6D22E24 |
-148.38 |
1.63 |
-8.91 |
-1.17 |
0 |
|
|
122874 |
50825006 |
1 |
FSN4O5C23H23 |
ABC4D5E23F23 |
-156.21 |
6.66 |
-9.1 |
-1.17 |
0 |
|
|
122875 |
50825007 |
1 |
SN4O4C22H28 |
AB4C4D22E28 |
-74.59 |
7.34 |
-9.24 |
-1.14 |
0 |
|
|
122876 |
50825008 |
1 |
SN4O4C25H28 |
AB4C4D25E28 |
-47.15 |
5.68 |
-8.63 |
-1.34 |
0 |
|
|
122877 |
50825211 |
1 |
SN4O5C23H26 |
AB4C5D23E26 |
-107.83 |
3.82 |
-8.66 |
-1.48 |
0 |
|
|
122878 |
50825267 |
1 |
SO3N4C25H26 |
AB3C4D25E26 |
-51.34 |
6.14 |
-8.26 |
-0.64 |
0 |
|
|
122879 |
50825268 |
1 |
SO3N5H19C23 |
AB3C5D19E23 |
17.18 |
8.3 |
-8.86 |
-1.18 |
0 |
|
|
122880 |
50825298 |
1 |
FSO3N4H21C23 |
ABC3D4E21F23 |
-73.15 |
4.59 |
-8.79 |
-0.87 |
0 |
|
|
122881 |
50825408 |
2 |
N2O2C13H17 |
A2B2C13D17 |
-169.33 |
3.43 |
-7.86 |
-0.26 |
0 |
|
|
122882 |
50825428 |
2 |
ON2C13H15 |
AB2C13D15 |
-60.87 |
4.4 |
-8.08 |
-0.41 |
0 |
|
|
122883 |
50825429 |
1 |
O2N4C25H28 |
A2B4C25D28 |
-38.88 |
5.2 |
-8.13 |
-0.51 |
0 |
|
|
122884 |
50825430 |
1 |
OSN7C25H35 |
ABC7D25E35 |
31.37 |
4.93 |
-8.1 |
-0.8 |
0 |
|
|
122885 |
50825448 |
1 |
OSN7C26H37 |
ABC7D26E37 |
27.11 |
3.17 |
-7.96 |
-0.7 |
0 |
|
|
122886 |
50825505 |
1 |
SO2N7C25H37 |
AB2C7D25E37 |
-15.08 |
5.93 |
-8.37 |
-0.73 |
0 |
|
|
122887 |
50825550 |
1 |
O3N4C23H30 |
A3B4C23D30 |
-114.54 |
2.08 |
-8.11 |
-0.45 |
0 |
|
|
122888 |
50825560 |
1 |
SO2N7C25H37 |
AB2C7D25E37 |
-19.44 |
5.86 |
-7.85 |
-0.61 |
0 |
|
|
122889 |
50825599 |
1 |
OSN7C23H33 |
ABC7D23E33 |
28.98 |
6.7 |
-8.34 |
-0.8 |
0 |
|
|
122890 |
50825602 |
1 |
OSN7C22H31 |
ABC7D22E31 |
35.51 |
5.5 |
-8.32 |
-0.85 |
0 |
|
|
122891 |
50825612 |
1 |
O3N5C24H33 |
A3B5C24D33 |
-105.48 |
3.43 |
-8.06 |
-0.44 |
0 |
|
|
122892 |
50825659 |
1 |
FSO3N5C23H24 |
ABC3D5E23F24 |
-59.52 |
5.41 |
-9.2 |
-1.08 |
0 |
|
|
122893 |
50825815 |
1 |
FOSN6C26H29 |
ABCD6E26F29 |
22.63 |
5.51 |
-8.39 |
-0.83 |
0 |
|
|
122894 |
50825816 |
1 |
SN7C22H33 |
AB7C22D33 |
87.49 |
4.01 |
-7.8 |
-0.58 |
0 |
|
|
122895 |
50825817 |
1 |
SN6C27H38 |
AB6C27D38 |
74.66 |
6.44 |
-7.96 |
-0.6 |
0 |
|
|
122896 |
50825818 |
1 |
SN6C28H40 |
AB6C28D40 |
64.95 |
6.32 |
-7.92 |
-0.59 |
0 |
|
|
122897 |
50825856 |
1 |
FOSN7C24H26 |
ABCD7E24F26 |
42.78 |
6.96 |
-8.15 |
-0.92 |
0 |
|
|
122898 |
50825951 |
1 |
SO2N6C26H36 |
AB2C6D26E36 |
0.28 |
3.38 |
-7.83 |
-0.62 |
0 |
|
|
122899 |
50826032 |
1 |
SO2N5C24H31 |
AB2C5D24E31 |
-37.76 |
11.94 |
-8.5 |
-0.68 |
0 |
|
|
122900 |
50826033 |
1 |
ClSO2N5C23H28 |
ABC2D5E23F28 |
-40.8 |
12.4 |
-8.38 |
-0.6 |
0 |
|
|
122901 |
50826085 |
1 |
ClSO2N5C24H30 |
ABC2D5E24F30 |
-50.94 |
7.68 |
-8.38 |
-0.55 |
0 |
|
|
122902 |
50826129 |
1 |
SO2N3C20H21 |
AB2C3D20E21 |
-2.46 |
8.61 |
-8.98 |
-0.92 |
0 |
|
|
122903 |
50826157 |
1 |
SO3N5H21C24 |
AB3C5D21E24 |
5.05 |
7.41 |
-8.59 |
-1.61 |
0 |
|
|
122904 |
50826180 |
1 |
O4N6C21H22 |
A4B6C21D22 |
-94.67 |
4.75 |
-9.11 |
-0.84 |
0 |
|
|
122905 |
50826225 |
1 |
O2F3N4C26H27 |
A2B3C4D26E27 |
-185.88 |
4.42 |
-9.05 |
-0.83 |
0 |
|
|
122906 |
50826310 |
2 |
N2O2H9C11 |
A2B2C9D11 |
-3.94 |
6.04 |
-9.02 |
-1.29 |
0 |
|
|
122907 |
50826311 |
1 |
O4N6C21H22 |
A4B6C21D22 |
-74.35 |
4.72 |
-8.78 |
-1.06 |
0 |
|
|
122908 |
50826312 |
1 |
ClO4N6C19H19 |
AB4C6D19E19 |
-81.51 |
5.31 |
-8.55 |
-1.35 |
0 |
|
|
122909 |
50826383 |
1 |
FO2N4C26H29 |
AB2C4D26E29 |
-85.77 |
2.95 |
-8.87 |
-0.68 |
0 |
|
|
122910 |
50826384 |
2 |
ON2C13H15 |
AB2C13D15 |
-36.32 |
2.54 |
-8.62 |
-0.64 |
0 |
|
|
122911 |
50826473 |
1 |
FO2N5H24C27 |
AB2C5D24E27 |
-5.48 |
3.38 |
-8.04 |
-0.96 |
0 |
|
|
122912 |
50826523 |
1 |
O3N4C29H30 |
A3B4C29D30 |
-23.92 |
6.63 |
-8.36 |
-0.73 |
0 |
|
|
122913 |
50826533 |
1 |
O3N4H24C26 |
A3B4C24D26 |
-18.67 |
3.49 |
-8.8 |
-0.93 |
0 |
|
|
122914 |
50826549 |
1 |
ON7C25H27 |
AB7C25D27 |
84.14 |
3.74 |
-8.83 |
-0.55 |
0 |
|
|
122915 |
50826577 |
1 |
O3N4H24C26 |
A3B4C24D26 |
-11.22 |
4.42 |
-8.16 |
-0.73 |
0 |
|
|
122916 |
50826578 |
1 |
FON4C23H23 |
ABC4D23E23 |
-18.17 |
3.61 |
-8.82 |
-0.99 |
0 |
|
|
122917 |
50826587 |
1 |
FON4H17C20 |
ABC4D17E20 |
20.99 |
4.15 |
-9.01 |
-1.07 |
0 |
|
|
122918 |
50826670 |
1 |
ClO2N6C28H29 |
AB2C6D28E29 |
3.21 |
3.82 |
-8.66 |
-0.74 |
0 |
|
|
122919 |
50826671 |
1 |
ClON6C28H31 |
ABC6D28E31 |
51.01 |
2.69 |
-8.58 |
-0.63 |
0 |
|
|
122920 |
50826672 |
1 |
ClON4H19C24 |
ABC4D19E24 |
57.95 |
6.93 |
-8.96 |
-0.99 |
0 |
|
|
122921 |
50826696 |
1 |
FO3N4H17C24 |
AB3C4D17E24 |
-32.48 |
3.97 |
-8.46 |
-1.02 |
0 |
|
|
122922 |
50826712 |
1 |
ON4H24C26 |
AB4C24D26 |
49.78 |
3.98 |
-8.45 |
-0.87 |
0 |
|
|
122923 |
50826732 |
1 |
ON4C23H26 |
AB4C23D26 |
19.27 |
4.17 |
-8.74 |
-0.77 |
0 |
|
|
122924 |
50826774 |
1 |
SN3O4C17H23 |
AB3C4D17E23 |
-141.46 |
7.89 |
-9.14 |
-0.19 |
0 |
|
|
122925 |
50826775 |
1 |
SN3O4C27H37 |
AB3C4D27E37 |
-168.08 |
5.81 |
-9.11 |
-0.82 |
0 |
|
|
122926 |
50826776 |
1 |
SN3O4C26H35 |
AB3C4D26E35 |
-161.2 |
6.08 |
-8.99 |
-0.68 |
0 |
|
|
122927 |
50826777 |
1 |
O3N5C23H25 |
A3B5C23D25 |
-14.89 |
4.63 |
-8.84 |
-1.24 |
0 |
|
|
122928 |
50826778 |
1 |
O3N5C22H25 |
A3B5C22D25 |
-26.79 |
6.36 |
-8.81 |
-1.27 |
0 |
|
|
122929 |
50826779 |
1 |
ClO4N5C25H30 |
AB4C5D25E30 |
-88.09 |
2.61 |
-8.84 |
-1.37 |
0 |
|
|
122930 |
50826806 |
2 |
O2N3C13H13 |
A2B3C13D13 |
-16.81 |
6.21 |
-8.52 |
-1.37 |
0 |
|
|
122931 |
50826816 |
1 |
FO3N5H24C26 |
AB3C5D24E26 |
-33.39 |
2.98 |
-8.8 |
-1.42 |
0 |
|
|
122932 |
50826921 |
1 |
ClSN3O4C22H26 |
ABC3D4E22F26 |
-147.36 |
6.18 |
-9.06 |
-1.26 |
0 |
|
|
122933 |
50827117 |
1 |
SN3O4C24H31 |
AB3C4D24E31 |
-153.22 |
3.04 |
-8.69 |
-0.85 |
0 |
|
|
122934 |
50827137 |
1 |
ClN2O2C21H23 |
AB2C2D21E23 |
-57.38 |
5.92 |
-8.97 |
-0.9 |
0 |
|
|
122935 |
50827295 |
1 |
N3O3C21H31 |
A3B3C21D31 |
-154.76 |
2.13 |
-8.95 |
-0.16 |
0 |
|
|
122936 |
50827313 |
1 |
FO3N4H19C22 |
AB3C4D19E22 |
-42.03 |
5.3 |
-9.51 |
-1.39 |
0 |
|
|
122937 |
50827376 |
3 |
NOC9H9 |
ABC9D9 |
-61.86 |
4.12 |
-9.05 |
-0.45 |
0 |
|
|
122938 |
50827377 |
1 |
ClN3O3H26C27 |
AB3C3D26E27 |
-71.17 |
6.5 |
-9.16 |
-0.92 |
0 |
|
|
122939 |
50827378 |
1 |
N3O4C18H25 |
A3B4C18D25 |
-167.0 |
5.22 |
-9.17 |
-0.35 |
0 |
|
|
122940 |
50827846 |
1 |
O2N5C20H21 |
A2B5C20D21 |
39.87 |
6.51 |
-8.39 |
-0.82 |
0 |
|
|
122941 |
50827972 |
1 |
O3N5C21H29 |
A3B5C21D29 |
-37.68 |
6.76 |
-8.16 |
-0.69 |
0 |
|
|
122942 |
50827973 |
1 |
O2N5C25H29 |
A2B5C25D29 |
28.92 |
6.54 |
-8.4 |
-0.9 |
0 |
|
|
122943 |
50828020 |
1 |
O3N5C25H29 |
A3B5C25D29 |
-5.78 |
6.48 |
-8.1 |
-0.9 |
0 |
|
|
122944 |
50828021 |
1 |
O2N4C17H22 |
A2B4C17D22 |
-4.15 |
7.53 |
-8.31 |
-0.8 |
0 |
|
|
122945 |
50828066 |
1 |
ClO2N4C19H19 |
AB2C4D19E19 |
26.25 |
4.93 |
-8.4 |
-0.93 |
0 |
|
|
122946 |
50828067 |
1 |
SO3N5C23H25 |
AB3C5D23E25 |
8.01 |
10.51 |
-8.25 |
-0.91 |
0 |
|
|
122947 |
50828068 |
1 |
ClO3N5C25H26 |
AB3C5D25E26 |
-12.45 |
3.26 |
-8.43 |
-0.89 |
0 |
|
|
122948 |
50828369 |
1 |
O3N4C22H24 |
A3B4C22D24 |
-68.07 |
3.72 |
-8.53 |
-0.76 |
0 |
|
|
122949 |
50828372 |
1 |
O2N4C23H26 |
A2B4C23D26 |
-51.69 |
2.75 |
-8.77 |
-0.75 |
0 |
|
|
122950 |
50828381 |
1 |
SO3N5C19H25 |
AB3C5D19E25 |
-54.98 |
8.36 |
-8.8 |
-0.6 |
0 |
|
|
122951 |
50828424 |
1 |
ClO2S2N3H20C23 |
AB2C2D3E20F23 |
-18.35 |
6.0 |
-8.7 |
-1.14 |
0 |
|
|
122952 |
50828437 |
1 |
O4N5C23H31 |
A4B5C23D31 |
-99.32 |
3.06 |
-9.43 |
-1.52 |
0 |
|
|
122953 |
50828529 |
1 |
ClO3N5C24H26 |
AB3C5D24E26 |
-34.26 |
5.61 |
-8.74 |
-1.3 |
0 |
|
|
122954 |
50828530 |
1 |
ClO4N5C24H26 |
AB4C5D24E26 |
-63.22 |
4.57 |
-8.63 |
-1.22 |
0 |
|
|
122955 |
50828531 |
1 |
FO4N5C23H24 |
AB4C5D23E24 |
-95.68 |
3.36 |
-8.95 |
-1.55 |
0 |
|
|
122956 |
50828532 |
1 |
FO4N5C23H24 |
AB4C5D23E24 |
-100.02 |
6.6 |
-9.05 |
-1.61 |
0 |
|
|
122957 |
50828533 |
1 |
O4N5C21H29 |
A4B5C21D29 |
-96.16 |
3.5 |
-9.49 |
-1.16 |
0 |
|
|
122958 |
50828561 |
1 |
O4N5C25H29 |
A4B5C25D29 |
-69.01 |
3.68 |
-8.52 |
-1.34 |
0 |
|
|
122959 |
50828586 |
1 |
FO2N3H18C19 |
AB2C3D18E19 |
-35.01 |
4.64 |
-9.7 |
-1.39 |
0 |
|
|
122960 |
50828605 |
1 |
S3O4N5C16H17 |
A3B4C5D16E17 |
-32.94 |
8.84 |
-9.39 |
-1.26 |
0 |
|
|
122961 |
50828658 |
1 |
FO3N4H23C26 |
AB3C4D23E26 |
-16.09 |
3.13 |
-8.3 |
-1.3 |
0 |